176797-26-5
176797-26-5 结构式
基本信息
中文别名
化合物 S 17092 英文别名
S 17092S 17092-1
S 17092 >=98% (HPLC)
(2S,3aS,7aS)-1-(((R,R)-2-Phenylcyclopropyl)carbonyl)-2-((thiazolidin-3-yl)carbonyl)octahydro-1H-indole
[(2S,3aS,7aS)-Octahydro-1-[[(1R,2R)-2-phenylcyclopropyl]carbonyl]-1H-indol-2-yl]-3-thiazolidinyl--methanone
Methanone, [(2S,3aS,7aS)-octahydro-1-[[(1R,2R)-2-phenylcyclopropyl]carbonyl]-1H-indol-2-yl]-3-thiazolidinyl-
[(2S,3aS,7aS)-2-(1,3-thiazolidine-3-carbonyl)-2,3,3a,4,5,6,7,7a-octahydroindol-1-yl]-[(1R,2R)-2-phenylcyclopropyl]methanone
物理化学性质
沸点622.6±55.0 °C(Predicted)
密度1.268±0.06 g/cm3(Predicted)
储存条件2-8°C
溶解度DMSO: ≥10mg/mL
酸度系数(pKa)-1.12±0.20(Predicted)
形态powder
颜色white to tan
旋光度 (Optical Rotation)[α]/D -140 to -170° in dichloromethane
InChI1S/C22H28N2O2S/c25-21(18-13-17(18)15-6-2-1-3-7-15)24-19-9-5-4-8-16(19)12-20(24)22(26)23-10-11-27-14-23/h1-3,6-7,16-20H,4-5,8-14H2/t16-,17-,18+,19-,20-/m0/s1
InChIKeyNXSXRIHXEQSYEZ-KNJMJIDISA-N
SMILESO=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)[C@@H]3C[C@H]3c4ccccc4)N5CCSC5