中文别名 |
Dabigatran ethyl ester hydrochloride(cas:211914-50-0) |
英文别名 |
Dabigatran ethyl ester hydrochloride,211914-50-0 |
CAS号 |
211914-50-0 |
SMILES |
NC(C1=CC=C(NCC2=NC3=CC(C(N(CCC(OCC)=O)C4=CC=CC=N4)=O)=CC=C3N2C)C=C1)=N.[H]Cl |
Inchi |
InChI=1S/C27H29N7O3.ClH/c1-3-37-25(35)13-15-34(23-6-4-5-14-30-23)27(36)19-9-12-22-21(16-19)32-24(33(22)2)17-31-20-10-7-18(8-11-20)26(28)29;/h4-12,14,16,31H,3,13,15,17H2,1-2H3,(H3,28,29);1H |
InchiKey |
FHWBKCGBULSVFO-UHFFFAOYSA-N |
分子式 Formula |
C27H30ClN7O3 |
分子量 Molecular Weight |
536.03 |
溶解度Solubility |
生物体外In Vitro:DMSO溶解度≥ 50 mg/mL(93.28 mM)H2O : 5 mg/mL(9.33 mM;Need ultrasonic)*"≥" 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 |