N-(4-methylphenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
N-(4-methylphenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | J023-0257 |
| Compound Name: | N-(4-methylphenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | Cc1ccc(CSC2NC(C3C(CC(NC=3N=2)=O)C(Nc2ccc(C)cc2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3443 |
| logD: | 2.3367 |
| logSw: | -2.8423 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.231 |
| InChI Key: | JGLLTYHFHWCYOK-KRWDZBQOSA-N |