2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxy-3-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxy-3-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxy-3-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Compound characteristics
| Compound ID: | D392-0167 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxy-3-methoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione |
| Molecular Weight: | 471.96 |
| Molecular Formula: | C23 H22 Cl N3 O4 S |
| Smiles: | CCOc1c(cccc1OC)C1CC(NC2=C1C(NC(=N2)SCc1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.198 |
| logD: | 3.1882 |
| logSw: | -3.6342 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.796 |
| InChI Key: | QSKBPVJZQOEODC-MRXNPFEDSA-N |