761414-79-3
英文名称
KR-62436
CAS
761414-79-3
分子式
C14H15N7O
分子量
297.32
MOL 文件
761414-79-3.mol
结构式
基本信息
英文别名
KR-62436 hydrate
3-Pyridinecarbonitrile, 6-[[2-[[2-(5-cyano-4,5-dihydro-1H-pyrazol-1-yl)-2-oxoethyl]amino]ethyl]amino]-
6-{2-[(5-Cyano-4,5-dihydropyrazol-1-yl)-2-oxoethylamino]ethylamino}nicotinonitrile dihydrochloride hydrate
3-Pyridinecarbonitrile, 6-[[2-[[2-(5-cyano-4,5-dihydro-1H-pyrazol-1-yl)-2-oxoethyl]amino]ethyl]amino]-
6-{2-[(5-Cyano-4,5-dihydropyrazol-1-yl)-2-oxoethylamino]ethylamino}nicotinonitrile dihydrochloride hydrate
物理化学性质
| 储存条件 | 2-8°C |
| 溶解度 | H2O: 12 mg/mL |
| 形态 | powder |
| 颜色 | white to beige |
| 水溶解性 | H2O: 5mg/mL, clear |
| InChI | 1S/C14H15N7O.2ClH.H2O/c15-7-11-1-2-13(19-9-11)18-6-5-17-10-14(22)21-12(8-16)3-4-20-21;;;/h1-2,4,9,12,17H,3,5-6,10H2,(H,18,19);2*1H;1H2 |
| InChIKey | FQZOFSJMRKZMSV-UHFFFAOYSA-N |
| SMILES | O.Cl.Cl.O=C(CNCCNc1ccc(cn1)C#N)N2N=CCC2C#N |