compound introduction
普拉西泮是一种苯二氮卓类药物。
CAS number:2955-38-6 molecular formula:C19H17ClN2O
普拉西泮是一种苯二氮卓类药物。
| Chinese alias | - | ||
| English alias | 1-(Cyclopropylmethyl)-5-phenyl-7-chloro-1,3-dihydro-2H-1,4-benzodiazepin-2-one; 1-Cyclopropylmethyl-5-phenyl-7-chloro-1H-1,4-benzodiazepin-2(3H)-one; 7-Chloro-1-(cyclopropylmethyl)-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one; Centrax; Demetrin; K 373; | ||
| CAS number | 2955-38-6 | molecular formula | C19H17ClN2O |
| molecular weight | 324.8 | Exact mass | - |
| PSA | 32.7 | logp | 3.6 |
| CAS | 2955-38-6 |
| UNII | Q30VCC064M |
| HMDB ID | HMDB0015527 |
| KEGG ID | D00470 |
| ChEBI ID | 8362 |
| Wikidata | Q2149443 |
| ChEMBL ID | CHEMBL969 |
| Wikipedia | Prazepam |
| NSC Number | NSC Number: NSC277179 |
| DrugBank ID | DB01588 |
| DrugCentral | 2240 |
| PharmGKB ID | PA164776668 |
| PubChem CID | 4890 |
| Nikkaji Number | J3.397I |
| DEA Code Number | 2764 (DEA IV类受管制物质) |
| NCI 词表代码 | C66458 |
| Pharos Ligand ID | 7WK1AMSTSPVN |
| DSSTox Substance ID | DTXSID4021181 |
| Metabolomics Workbench ID | 43579 |
| European Community (EC) Number | 220-975-8 |
| PubChem Reference Collection SID | 483926193 |
| United States Adopted Name (USAN) | PRAZEPAM |
| International Nonproprietary Names (INN) | PRAZEPAM |
| LogP | 3.73 |
| XLogP3 | 3.6 |
| 熔点 | 145 - 146 °C |
| 复杂性 | 482 |
| 溶解度 | 3.99e-03 g/L |
| Exact Mass | 324.1029409 |
| Human Drugs | 药品 |
| 形式电荷 | 0 |
| 物理描述 | 固体 |
| 重原子计数 | 23 |
| Molecular Weight | 324.8 |
| Monoisotopic Mass | 324.1029409 |
| 可旋转键计数 | 3 |
| 氢键供体计数 | 0 |
| 氢键受体计数 | 2 |
| Kovats 保留指数 | 半标准非极性:2685 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 32.7 Ų |
| Collision Cross Section | 174 Ų [M+H]+ [CCS类型:TW;方法:主要混合IMS/Tof校准试剂盒(Waters)] |
| 定义键立体中心计数 | 0 |
| 定义原子立体中心计数 | 0 |
| 未定义键立体中心计数 | 0 |
| 未定义原子手性中心计数 | 0 |
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