| 中文别名 | S63845(cas:1799633-27-4) |
| 英文别名 | S63845,1799633-27-4 |
| CAS号 | 1799633-27-4 |
| SMILES | CC(C(Cl)=C(OCCN1CCN(C)CC1)C=C2)=[C@@]2[C@]3=C(C4=CC=C(F)O4)SC5=NC=NC(O[C@H](CC6=C(OCC7=CC=NN7CC(F)(F)F)C=CC=C6)C(O)=O)=C53 |
| Inchi | InChI=1S/C39H37ClF4N6O6S/c1-23-26(7-8-28(34(23)40)53-18-17-49-15-13-48(2)14-16-49)32-33-36(45-22-46-37(33)57-35(32)29-9-10-31(41)55-29)56-30(38(51)52)19-24-5-3-4-6-27(24)54-20-25-11-12-47-50(25)21-39(42,43)44/h3-12,22,30H,13-21H2,1-2H3,(H,51,52)/t30-/m1/s1 |
| InchiKey | ZFBHXVOCZBPADE-SSEXGKCCSA-N |
| 分子式 Formula | C39H37ClF4N6O6S |
| 分子量 Molecular Weight | 829.26 |
| 闪点 FP | 469.5±34.3 ℃ |
| 沸点 Boiling point | 852.6±65.0 ℃ at 760 mmHg |
| Polarizability极化度 | 81.2±0.5 10-24cm3 |
| 密度 Density | 1.5±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±0.3 mmHg at 25℃ |
| 溶解度Solubility | 生物体外In Vitro:DMSO溶解度33.33 mg/mL(40.19 mM;Need ultrasonic)H2O< 0.1 mg/mL(insoluble) |
| 性状 | Solid |
| 储藏条件 Storage conditions | 4℃, protect from light, stored under nitrogen * In solvent : -80℃, 6 months月; -20℃, 1 month月 (protect from light, stored under nitrogen) |
