5-(1,4-Diazepan-1-Ylsulfonyl)-1-Isoquinolinol Hydrochloride (1:1)
[CAS# 155558-32-0]

Identification

• Name: 5-(1,4-Diazepan-1-Ylsulfonyl)-1-Isoquinolinol Hydrochloride (1:1)
• Synonyms: "5-[(hexahydro-1H-1,4-diazepin-1-yl)sulfonyl]-1(2H)-isoquinolinone, monohydrochloride"; [105628-72-6]; 1-(1-Hydroxy-5-isoquinolinesulfonyl)homopiperazine monohydrochloride
• Molecular Formula: C₁₄H₁₈ClN₃O₃S
• Molecular Weight: 343.83
• CAS Registry Number: 155558-32-0
• SMILES: C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3O.Cl
• InChI: 1S/C14H17N3O3S.ClH/c18-14-12-3-1-4-13(11(12)5-7-16-14)21(19,20)17-9-2-6-15-8-10-17;/h1,3-5,7,15H,2,6,8-10H2,(H,16,18);1H
• InChIKey: XWWFOUVDVJGNNG-UHFFFAOYSA-N

Properties

• Refractive index: (Cal.)
• solubility: Soluble to 20 mM in water