| CAS NO: | 781649-09-0 |
| 中文别名 | Telcagepant(cas:781649-09-0) |
| 英文别名 | Telcagepant,781649-09-0 |
| CAS号 | 781649-09-0 |
| SMILES | O=C1NC2=C(N1C3CCN(C(N[C@@H]4CC[C@@H](C5=CC=CC(F)=C5F)CN(CC(F)(F)F)C4=O)=O)CC3)C=CC=N2 |
| Inchi | InChI=1S/C26H27F5N6O3/c27-18-4-1-3-17(21(18)28)15-6-7-19(23(38)36(13-15)14-26(29,30)31)33-24(39)35-11-8-16(9-12-35)37-20-5-2-10-32-22(20)34-25(37)40/h1-5,10,15-16,19H,6-9,11-14H2,(H,33,39)(H,32,34,40)/t15-,19-/m1/s1 |
| InchiKey | CGDZXLJGHVKVIE-DNVCBOLYSA-N |
| 分子式 Formula | C26H27F5N6O3 |
| 分子量 Molecular Weight | 566.52 |
| Polarizability极化度 | 52.5±0.5 10-24cm3 |
| 密度 Density | 1.5±0.1 g/cm3 |
| 溶解度Solubility | 生物体外In Vitro:DMSO溶解度≥ 50 mg/mL(88.26 mM)*"≥" means soluble可溶, but saturation unknown溶解度未知. |
| 性状 | 固体粉末,Power |
| 储藏条件 Storage conditions | -20℃ 3 years年 4℃ 2 years年 / In solvent溶液中:-80℃ 6 months月 -20℃ 1 month月 |
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