3-[7-(5-chloro-2-methylphenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)propanamide
Chemical Structure Depiction of
3-[7-(5-chloro-2-methylphenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)propanamide
3-[7-(5-chloro-2-methylphenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)propanamide
Compound characteristics
| Compound ID: | F656-0410 |
| Compound Name: | 3-[7-(5-chloro-2-methylphenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)propanamide |
| Molecular Weight: | 476.98 |
| Molecular Formula: | C22 H25 Cl N4 O4 S |
| Smiles: | Cc1ccc(cc1n1c(C)c(C)c2C(N(CCC(NC3CCS(C3)(=O)=O)=O)C=Nc12)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8877 |
| logD: | 1.8877 |
| logSw: | -3.2943 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.977 |
| InChI Key: | HUCMWQALHOZIQE-KRWDZBQOSA-N |