中文别名 | 匹莫迪韦;吡莫地韦;VX-787;VX 787;VX787; JNJ-872;JNJ 872;JNJ872;VRT-0928787; VRT 0928787;VRT0928787;吡莫地尔; (2S,3S)-3-((5-氟-2-(5-氟-1H-吡咯并[2,3-b]吡啶-3-基)嘧啶-4-基)氨基)双环[2.2.2 ]辛烷-2-羧酸; |
英文别名 | Pimodivir;VX-787;VX-787; VX 787; VX787; JNJ-872; JNJ 872; JNJ872; VRT-0928787; VRT 0928787; VRT0928787;pimodivir; (2S,3S)-3-((5-Fluoro-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl)amino)bicyclo[2.2.2]octane-2-carboxylic Acid; |
CAS号 | 1629869-44-8 |
SMILES | O=C([C@H]1C(CC2)CCC2[C@@H]1NC3=NC(C4=CNC5=NC=C(F)C=C54)=NC=C3F)O |
Inchi | InChI=1S/C20H19F2N5O2/c21-11-5-12-13(7-24-17(12)23-6-11)18-25-8-14(22)19(27-18)26-16-10-3-1-9(2-4-10)15(16)20(28)29/h5-10,15-16H,1-4H2,(H,23,24)(H,28,29)(H,25,26,27)/t9?,10?,15-,16-/m0/s1 |
InchiKey | JGPXDNKSIXAZEQ-SBBZOCNPSA-N |
分子式 Formula | C20H19F2N5O2 |
分子量 Molecular Weight | 399.39 |
闪点 FP | 301.0±30.1°摄氏度 |
沸点 Boiling point | 760毫米汞柱时为574.1±50.0℃ |
密度 Density | 1.5±0.1克/厘米3 |
蒸汽压 Vapor Pressure | 25℃时0.0±1.7 mmHg |
溶解度Solubility | 生物体外In Vitro:DMSO溶解度100 mg/mL(250.38 mM;Need ultrasonic) |
性状 | 固体粉末,Power |
储藏条件 Storage conditions | 存放在阴凉干燥处,短期(数天至数周)在0-4℃下,长期(数月至数年)在-20℃下保存。 |