化学标识
Dasatinib Monohydrate
未列出 · C22H28ClN7O3S
01化学标识
| Lazychem ID | LC-77072 |
|---|---|
| CAS RN | 未列出 |
| PubChem CID | 11540687 |
| Molecular formula | C22H28ClN7O3S |
| Molecular weight | 506.0 g/mol |
| IUPAC name | N-(2-chloro-6-methylphenyl)-2-[[6-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methylpyrimidin-4-yl]amino]-1,3-thiazole-5-carboxamide;hydrate |
| InChIKey | XHXFZZNHDVTMLI-UHFFFAOYSA-N |
02结构与立体化学
2D structurePubChem CID 11540687

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.
| Defined stereocentres | 0 |
|---|---|
| Ring count | 4 |
| Secondary amines | 1 |
| Tertiary amines | 2 |
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)C2=CN=C(S2)NC3=CC(=NC(=N3)C)N4CCN(CC4)CCO.O |
|---|---|
| InChI | 未列出 |
03印度监管状态
Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.
04名称与关联
原料药与母体药物
未列出
名称与关联
05来源
- S01PubChem CID 11540687
Structure and machine-readable chemical identifiers.
