N-(3-chloro-4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
N-(3-chloro-4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | J023-0245 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-{[(3-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide |
| Molecular Weight: | 468.96 |
| Molecular Formula: | C23 H21 Cl N4 O3 S |
| Smiles: | Cc1cccc(CSC2NC(C3C(CC(NC=3N=2)=O)C(Nc2ccc(C)c(c2)[Cl])=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8119 |
| logD: | 3.8043 |
| logSw: | -4.1083 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.231 |
| InChI Key: | URVFZPRPIJDJAS-MRXNPFEDSA-N |