2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-hydroxy-4-methoxyphenyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-hydroxy-4-methoxyphenyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-hydroxy-4-methoxyphenyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D392-0766 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-hydroxy-4-methoxyphenyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 457.93 |
| Molecular Formula: | C22 H20 Cl N3 O4 S |
| Smiles: | CN1C2=C(C(CC(N2)=O)c2ccc(c(c2)O)OC)C(N=C1SCc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5216 |
| logD: | 2.4216 |
| logSw: | -3.4255 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.26 |
| InChI Key: | ZEMVIZCTNOTEBG-HNNXBMFYSA-N |