2-{[(3-chlorophenyl)methyl]sulfanyl}-1-methyl-5-(4-propoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-1-methyl-5-(4-propoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
2-{[(3-chlorophenyl)methyl]sulfanyl}-1-methyl-5-(4-propoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D392-0721 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-1-methyl-5-(4-propoxyphenyl)-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 469.99 |
| Molecular Formula: | C24 H24 Cl N3 O3 S |
| Smiles: | CCCOc1ccc(cc1)C1CC(NC2=C1C(N=C(N2C)SCc1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3742 |
| logD: | 4.2741 |
| logSw: | -4.6378 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.5 |
| InChI Key: | CZZIQNDTMWIVNE-IBGZPJMESA-N |