3-(5,6-dimethyl-4-oxo-7-phenyl-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-(5,6-dimethyl-4-oxo-7-phenyl-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)propanamide
3-(5,6-dimethyl-4-oxo-7-phenyl-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: | F656-0127 |
| Compound Name: | 3-(5,6-dimethyl-4-oxo-7-phenyl-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)propanamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C21 H24 N4 O4 S |
| Smiles: | Cc1c2C(N(CCC(NC3CCS(C3)(=O)=O)=O)C=Nc2n(c2ccccc2)c1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7085 |
| logD: | 0.7085 |
| logSw: | -2.2505 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.277 |
| InChI Key: | BHWXYVPBBVQKAU-MRXNPFEDSA-N |