| 中文别名 | Ceralasertib(cas:1352226-88-0) |
| 英文别名 | Ceralasertib,1352226-88-0 |
| CAS号 | 1352226-88-0 |
| SMILES | O=[S@@](C1(CC1)C2=NC(C3=C4C(NC=C4)=NC=C3)=NC(N5CCOC[C@H]5C)=C2)(C)=N |
| Inchi | InChI=1S/C20H24N6O2S/c1-13-12-28-8-7-26(13)18-9-17(20(4-5-20)29(2,21)27)24-19(25-18)15-10-22-11-16-14(15)3-6-23-16/h3,6,9-11,13,21,23H,4-5,7-8,12H2,1-2H3/t13-,29-/m1/s1 |
| InchiKey | DTTJKLNXNZAVSM-JYCIKRDWSA-N |
| 分子式 Formula | C20H24N6O2S |
| 分子量 Molecular Weight | 412.51 |
| 闪点 FP | 317.0±34.3 ℃ |
| 沸点 Boiling point | 600.5±65.0 ℃ at 760 mmHg |
| Polarizability极化度 | 43.8±0.5 10-24cm3 |
| 密度 Density | 1.5±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±1.7 mmHg at 25℃ |
| 溶解度Solubility | 生物体外In Vitro:DMSO溶解度≥ 38 mg/mL(92.12 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 |
