5-{[(3S)-3-Isobutyl-1-piperazinyl]sulfonyl}isoquinoline dihydrochloride
[CAS# 936233-01-1]

Identification

• Name: 5-{[(3S)-3-Isobutyl-1-piperazinyl]sulfonyl}isoquinoline dihydrochloride
• Synonyms: (S)-5-(3-Isobutyl-piperazine-1-sulfonyl)-isoquinoline dihydrochloride; MFCD09834594
• Molecular Formula: C₁₇H₂₅Cl₂N₃O₂S
• Molecular Weight: 406.37
• CAS Registry Number: 936233-01-1
• SMILES: CC(C)C[C@H]1CN(CCN1)S(=O)(=O)c2cccc3c2ccnc3.Cl.Cl
• InChI: 1S/C17H23N3O2S.2ClH/c1-13(2)10-15-12-20(9-8-19-15)23(21,22)17-5-3-4-14-11-18-7-6-16(14)17;;/h3-7,11,13,15,19H,8-10,12H2,1-2H3;2*1H/t15-;;/m0../s1
• InChIKey: MQJQSMWCGPCSMI-CKUXDGONSA-N

Properties

• Refractive index: (Cal.)