| 中文别名 | GSK2126458 (GSK458)(MSDS,1086062-66-9) |
| 英文别名 | GSK2126458 (GSK458);GSK2126458 (GSK458): |
| CAS号 | 1086062-66-9 |
| SMILES | COc1c(cc(cn1)c2ccc3c(c2)c(ccn3)c4ccnnc4)NS(=O)(=O)c5ccc(cc5F)F |
| Inchi | InChI=1S/C25H17F2N5O3S/c1-35-25-23(32-36(33,34)24-5-3-18(26)12-21(24)27)11-17(13-29-25)15-2-4-22-20(10-15)19(7-8-28-22)16-6-9-30-31-14-16/h2-14,32H,1H3 |
| InchiKey | CGBJSGAELGCMKE-UHFFFAOYSA-N |
| 分子式 Formula | C25H17F2N5O3S |
| 分子量 Molecular Weight | 505.5 |
| 闪点 FP | 386.6±35.7 ℃ |
| 沸点 Boiling point | 715.6±70.0 ℃ at 760 mmHg |
| Polarizability极化度 | 51.0±0.5 10-24cm3 |
| 密度 Density | 3.0900 |
| 溶解度Solubility | DMSO ≥98mg/mL Water<1.2mg/mL Ethanol<1.2mg/mL |
| 储藏条件 Storage conditions | 储存温度-20℃ |
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