1-{6-[2-(3,5-dimethylanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}-N-methylpiperidine-3-carboxamide
Chemical Structure Depiction of
1-{6-[2-(3,5-dimethylanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}-N-methylpiperidine-3-carboxamide
1-{6-[2-(3,5-dimethylanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}-N-methylpiperidine-3-carboxamide
Compound characteristics
| Compound ID: | L864-1523 |
| Compound Name: | 1-{6-[2-(3,5-dimethylanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}-N-methylpiperidine-3-carboxamide |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C22 H26 N6 O3 S |
| Smiles: | Cc1cc(C)cc(c1)NC(CN1C=Nc2c(C1=O)sc(n2)N1CCCC(C1)C(NC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2686 |
| logD: | 2.2686 |
| logSw: | -2.7087 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.106 |
| InChI Key: | YYCVGBIRXCLFOO-HNNXBMFYSA-N |