(1S,2S)-2-(2-{[3-(1H-Benzimidazol-2-Yl)Propyl](Methyl)Amino}Ethyl)-6-Fluoro-1-Isopropyl-1,2,3,4-Tetrahydro-2-Naphthalenyl Cyclopropanecarboxylate Dihydrochloride
[CAS# 357400-13-6]

Identification

• Name: (1S,2S)-2-(2-{[3-(1H-Benzimidazol-2-Yl)Propyl](Methyl)Amino}Ethyl)-6-Fluoro-1-Isopropyl-1,2,3,4-Tetrahydro-2-Naphthalenyl Cyclopropanecarboxylate Dihydrochloride
• Synonyms: (1S,2S)-2-[2-[[3-(1H-Benzimidazol-2-yl)propyl]methylamino]ethyl]-6-fluoro-1,2,3,4-tetrahydro-1-(1-methylethyl)-2-naphthalenyl cyclopropanecarboxylate dihydrochloride; [357400-13-6]; NNC 55-0396
• Molecular Formula: C₃₀H₄₀Cl₂FN₃O₂
• Molecular Weight: 564.56
• CAS Registry Number: 357400-13-6
• SMILES: CC(C)[C@H]1C2=C(CC[C@@]1(CCN(C)CCCC3=NC4=CC=CC=C4N3)OC(=O)C5CC5)C=C(C=C2)F.Cl.Cl
• InChI: 1S/C30H38FN3O2.2ClH/c1-20(2)28-24-13-12-23(31)19-22(24)14-15-30(28,36-29(35)21-10-11-21)16-18-34(3)17-6-9-27-32-25-7-4-5-8-26(25)33-27;;/h4-5,7-8,12-13,19-21,28H,6,9-11,14-18H2,1-3H3,(H,32,33);2*1H/t28-,30-;;/m0../s1
• InChIKey: BCCQNBXHUMKLFW-HNQRYHMESA-N

Properties

• Refractive index: (Cal.)
• solubility: Soluble to 25 mM in water