英文别名 | (3R)-N-{(2R)-3-(4-Chlorophenyl)-1-[4-cyclohexyl-4-(1H-1,2,4-triazol-1-ylmethyl)-1-piperidinyl]-1-oxo-2-propanyl}-1,2,3,4-tetrahydro-3-isoquinolinecarboxamide |
CAS号 | 312637-48-2 |
SMILES | C1CCC(CC1)C2(CCN(CC2)C(=O)[C@@H](CC3=CC=C(C=C3)Cl)NC(=O)[C@H]4CC5=CC=CC=C5CN4)CN6C=NC=N6 |
Inchi | InChI=1S/C33H41ClN6O2/c34-28-12-10-24(11-13-28)18-30(38-31(41)29-19-25-6-4-5-7-26(25)20-36-29)32(42)39-16-14-33(15-17-39,21-40-23-35-22-37-40)27-8-2-1-3-9-27/h4-7,10-13,22-23,27,29-30,36H,1-3,8-9,14-21H2,(H,38,41)/t29-,30-/m1/s1 |
InchiKey | HLCHESOMJVGDSJ-LOYHVIPDSA-N |
分子式 Formula | C33H41ClN6O2 |
分子量 Molecular Weight | 589 |
Polarizability极化度 | 65.9±0.5 10-24cm3 |
密度 Density | 1.3±0.1 g/cm3 |
储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |