Piperazines

Thermo Scientific Chemicals HEPES sodium salt, 99%

CAS: 75277-39-3 Molecular Formula: C8H17N2NaO4S Molecular Weight (g/mol): 260.28 MDL Number: MFCD00036463 InChI Key: RDZTWEVXRGYCFV-UHFFFAOYSA-M Synonym: hepes sodium salt,hepes hemisodium salt,sodium 2-4-2-hydroxyethyl piperazin-1-yl ethanesulfonate,unii-z9fto91o8a,1-piperazineethanesulfonic acid, 4-2-hydroxyethyl-, monosodium salt,z9fto91o8a,sodium 4-2-hydroxyethyl piperazin-1-ylethanesulphonate,4-2-hydroxyethyl piperazine-1-ethanesulfonic acid sodium salt,4-2-hydroxyethyl piperazine-1-ethanesulfonic acid hemisodium salt PubChem CID: 2724248 ChEBI: CHEBI:46758 SMILES: [Na+].OCCN1CCN(CCS([O-])(=O)=O)CC1

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Ketoconazole, 98%

CAS: 65277-42-1 Molecular Formula: C26H28Cl2N4O4 Molecular Weight (g/mol): 534.452 MDL Number: MFCD00058579 InChI Key: XMAYWYJOQHXEEK-SIULDFEJSA-N Synonym: ketoconazole PubChem CID: 76973198 IUPAC Name: 2,2,2-trideuterio-1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone SMILES: CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl

1-(2-Aminoethyl)piperazine, 99%

CAS: 140-31-8 Molecular Formula: C6H15N3 Molecular Weight (g/mol): 129.21 MDL Number: MFCD00005971 InChI Key: IMUDHTPIFIBORV-UHFFFAOYSA-N Synonym: n-aminoethylpiperazine,n-2-aminoethyl piperazine,1-2-aminoethyl piperazine,2-piperazin-1-yl ethanamine,1-piperazineethanamine,aminoethylpiperazine,1-piperazineethylamine,1-aminoethylpiperazine,piperazineethanamine,piperazine, 1-2-aminoethyl PubChem CID: 8795 IUPAC Name: 2-piperazin-1-ylethanamine SMILES: NCCN1CCNCC1

1-Phenylpiperazine, 98+%

CAS: 92-54-6 Molecular Formula: C10H14N2 Molecular Weight (g/mol): 162.236 MDL Number: MFCD00005957 InChI Key: YZTJYBJCZXZGCT-UHFFFAOYSA-N Synonym: phenylpiperazine,n-phenylpiperazine,piperazine, 1-phenyl,1-phenyl-piperazine,n-phenyldiethylenediamine,1-fenylpiperazin czech,unii-j9225cbi7d,n-phenyl piperazine,1-phenyl piperazine,ccris 4334 PubChem CID: 7096 IUPAC Name: 1-phenylpiperazine SMILES: C1CN(CCN1)C2=CC=CC=C2

Thermo Scientific Chemicals Itraconazole, 99%

CAS: 84625-61-6 Molecular Formula: C35H38Cl2N8O4 Molecular Weight (g/mol): 705.64 MDL Number: MFCD00870168,MFCD00941396 InChI Key: VHVPQPYKVGDNFY-ZPGVKDDISA-N Synonym: itraconazole-d5,itraconazole,oriconazole-d5,triasporin-d5,sporamelt-d5,itrizole-d5,sporanox-d5,+/--4-4-4-4-2r,4s-2,4-dichlorophenyl-2-1h-1,2,4-triazol-1-ylmethyl-1,3-dioxolan-4-yl methoxy phenyl-1-piperazinyl phenyl-2,4-dihydro-2-1-methylpropyl-d5-3h-1,2,4-triazol-3-one,2h5-4-4-4-4-2-1h-1,2,4-triazol-1-yl methyl-2-2,4-dichlorophenyl-1,3-dioxolan-4-yl methoxy phenyl piperazin-1-yl phenyl-1-sec-butyl-1h-1,2,4-triazol-5 4h-one,2-3,3,4,4,4-2 h? butan-2-yl-4-4-4-4-2r,4s-2-2,4-dichlorophenyl-2-1,2,4-triazol-1-ylmethyl-1,3-dioxolan-4-yl methoxy phenyl piperazin-1-yl phenyl-1,2,4-triazol-3-one PubChem CID: 45039617 IUPAC Name: 4-[4-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-(3,3,4,4,4-pentadeuteriobutan-2-yl)-1,2,4-triazol-3-one SMILES: CCC(C)N1N=CN(C1=O)C1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(OC[C@H]2CO[C@@](CN3C=NC=N3)(O2)C2=CC=C(Cl)C=C2Cl)C=C1

1,4-Diazabicyclo[2.2.2]octane, 97%

CAS: 280-57-9 Molecular Formula: C₆H₁₂N₂ Molecular Weight (g/mol): 112.17 MDL Number: MFCD00006689 InChI Key: IMNIMPAHZVJRPE-UHFFFAOYSA-N Synonym: 1,4-diazabicyclo 2.2.2 octane,triethylenediamine,dabco,dabco 33lv,1,4-ethylenepiperazine,dabco crystal,teda,texacat td 100,dabco s-25 PubChem CID: 9237 IUPAC Name: 1,4-diazabicyclo[2.2.2]octane SMILES: C1CN2CCN1CC2

EPPS, 99%

CAS: 16052-06-5 Molecular Formula: C9H20N2O4S Molecular Weight (g/mol): 252.329 MDL Number: MFCD00006160 InChI Key: OWXMKDGYPWMGEB-UHFFFAOYSA-N Synonym: hepps,epps,4-2-hydroxyethyl-1-piperazinepropanesulfonic acid,3-4-2-hydroxyethyl piperazin-1-yl propane-1-sulfonic acid,1-piperazinepropanesulfonic acid, 4-2-hydroxyethyl,n-2-hydroxyethyl piperazine-n'-3-propanesulfonic acid,4-2-hydroxyethyl piperazine-1-propanesulfonic acid,4-2-hydroxyethyl-1-piperazinepropane sulfonic acid,4-2-hydroxyethyl-1-piperazinepropanesulphonic acid PubChem CID: 85255 ChEBI: CHEBI:42298 IUPAC Name: 3-[4-(2-hydroxyethyl)piperazin-1-yl]propane-1-sulfonic acid SMILES: C1CN(CCN1CCCS(=O)(=O)O)CCO

1-Ethylpiperazine, 98%

CAS: 5308-25-8 Molecular Formula: C6H14N2 Molecular Weight (g/mol): 114.192 MDL Number: MFCD00059912 InChI Key: WGCYRFWNGRMRJA-UHFFFAOYSA-N Synonym: n-ethylpiperazine,piperazine, 1-ethyl,1-ethylpiperazin,1-ethyl-piperazine,ethylpiperazine,n-ethyl piperazine,unii-6w2bw0v73g,1-ethyl-piperazin,ethypiperazine,ethyl piperazine PubChem CID: 79196 IUPAC Name: 1-ethylpiperazine SMILES: CCN1CCNCC1

4-(1-Piperazinyl)aniline, 95%

CAS: 67455-41-8 Molecular Formula: C10H15N3 Molecular Weight (g/mol): 177.25 MDL Number: MFCD01365906 InChI Key: VAVOYRCCWLRTMS-UHFFFAOYSA-N Synonym: 4-piperazin-1-yl aniline,1-4-aminophenyl piperazine,4-piperazinoaniline,4-piperazin-1-yl-phenylamine,4-1-piperazinyl aniline,benzenamine,4-1-piperazinyl,4-piperazinylphenylamine,benzenamine, 4-1-piperazinyl,4-piperazin-1-ylphenylamine,1-p-aminophenyl piperazine PubChem CID: 422925 IUPAC Name: 4-piperazin-1-ylaniline SMILES: NC1=CC=C(C=C1)N1CCNCC1

4-(4-Acetyl-1-piperazinyl)benzeneboronic acid pinacol ester, 95%, Thermo Scientific Chemicals

CAS: 1218791-38-8 Molecular Formula: C18H27BN2O3 Molecular Weight (g/mol): 330.235 MDL Number: MFCD13195756 InChI Key: VRZVSHHLWMAHAZ-UHFFFAOYSA-N Synonym: 4-4-acetyl-1-piperazinyl phenylboronic acid pinacol ester,1-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazin-1-yl ethanone,4-4-acetylpiperazino phenylboronic acid pinacol ester,1-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl-1-piperazinyl ethanone,4-4-acetyl-1-piperazinyl phenylboronicacidpinacolester,4-4-acetylpiperazino phenylboronic acid, pinacol ester,4-4-acetyl-1-piperazinyl benzeneboronic acid pinacol ester,1-4-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl piperazin-1-yl ethan-1-one PubChem CID: 53217141 IUPAC Name: 1-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazin-1-yl]ethanone SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)N3CCN(CC3)C(=O)C

1-Boc-4-(2-chloroethyl)piperazine, 97%

CAS: 208167-83-3 Molecular Formula: C11H21ClN2O2 Molecular Weight (g/mol): 248.751 MDL Number: MFCD08443993 InChI Key: MYOWELLYEZMECA-UHFFFAOYSA-N Synonym: tert-butyl 4-2-chloroethyl piperazine-1-carboxylate,tert-butyl 4-2-chloroethyl tetrahydro-1 2h-pyrazinecarboxylate,1-boc-4-2-chloroethyl piperazine,tert-butyl 4-2-chloroethyl piperazinecarboxylate,1-piperazinecarboxylic acid, 4-2-chloroethyl-, 1,1-dimethylethyl ester,4-2-chloroethyl piperazine, n1-boc protected,4-2-chloroethyl piperazine,n1-boc protected,tertbutylchloroethyltetrahydropyrazinecarboxylate,tert-butyl 4-2-chloroethyl tetrahydro-1 2h-pyraz PubChem CID: 22106269 IUPAC Name: tert-butyl 4-(2-chloroethyl)piperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCN(CC1)CCCl

3-Methyl-1-(2-nitro-phenyl)-piperazine, Thermo Scientific™

1-Boc-4-(2-hydroxyethyl)piperazine, 97%

CAS: 77279-24-4 Molecular Formula: C11H22N2O3 Molecular Weight (g/mol): 230.308 MDL Number: MFCD00728947 InChI Key: VRXIOAYUQIITBU-UHFFFAOYSA-N Synonym: tert-butyl 4-2-hydroxyethyl piperazine-1-carboxylate,1-boc-4-2-hydroxyethyl piperazine,1-tert-butyloxy carbonyl-4-hydroxyethyl piperazine,tert-butyl 4-2-hydroxyethyl tetrahydro-1 2h-pyrazinecarboxylate,1-boc-4-2-hydroxyethyl-piperazine,4-2-hydroxy-ethyl-piperazine-1-carboxylic acid tert-butyl ester,1-piperazinecarboxylic acid, 4-2-hydroxyethyl-, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl-4-2-hydroxyethyl piperazine,tert-butyl 4-2-hydroxyethyl-1-piperazinecarboxylate,4-2-hydroxyethyl piperazine-1-carboxylic acid tert-butyl ester PubChem CID: 735736 IUPAC Name: tert-butyl 4-(2-hydroxyethyl)piperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCN(CC1)CCO

Naftopidil hydrochloride, 98+%, Thermo Scientific Chemicals

CAS: 1164469-60-6 Molecular Formula: C24H29ClN2O3 Molecular Weight (g/mol): 428.957 MDL Number: MFCD09971016 InChI Key: VQAAEWMEVIOHTJ-UHFFFAOYSA-N Synonym: naftopidil hydrochloride,opera_id_518,1-4-2-methoxyphenyl piperazin-1-yl-3-naphthalen-1-yloxypropan-2-ol hydrochloride,4-2-methoxyphenyl-?-1-naphthalenyloxy methyl-1-piperazineethanol hydrochloride PubChem CID: 6603044 IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol;hydrochloride SMILES: COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=CC4=CC=CC=C43)O.Cl

2-{4-[5-chloro-3-(trifluoromethyl)-2-pyridyl]piperazino}ethan-1-ol, 97%, Thermo Scientific™