| CAS NO: | 2097132-94-8 |
| 中文别名 | Pralsetinib(cas:2097132-94-8) |
| 英文别名 | Pralsetinib,2097132-94-8 |
| CAS号 | 2097132-94-8 |
| SMILES | O=C([C@@]1(OC)CC[C@H](C2=NC(NC3=NNC(C)=C3)=CC(C)=N2)CC1)N[C@H](C4=CC=C(N5N=CC(F)=C5)N=C4)C |
| Inchi | InChI=1S/C27H32FN9O2/c1-16-11-22(33-23-12-17(2)35-36-23)34-25(31-16)19-7-9-27(39-4,10-8-19)26(38)32-18(3)20-5-6-24(29-13-20)37-15-21(28)14-30-37/h5-6,11-15,18-19H,7-10H2,1-4H3,(H,32,38)(H2,31,33,34,35,36)/t18-,19-,27-/m0/s1 |
| InchiKey | GBLBJPZSROAGMF-BATDWUPUSA-N |
| 分子式 Formula | C27H32FN9O2 |
| 分子量 Molecular Weight | 533.6 |
| 闪点 FP | 437.1±32.9 ℃ |
| 沸点 Boiling point | 799.1±60.0 ℃ at 760 mmHg |
| Polarizability极化度 | 57.3±0.5 10-24cm3 |
| 密度 Density | 1.4±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±2.8 mmHg at 25℃ |
| 溶解度Solubility | 生物体外In Vitro:DMSO溶解度≥ 100 mg/mL(187.41 mM)H2O< 0.1 mg/mL(insoluble)*"≥" 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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