2-{[(3-chlorophenyl)methyl]sulfanyl}-5-{4-[(propan-2-yl)oxy]phenyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-5-{4-[(propan-2-yl)oxy]phenyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
2-{[(3-chlorophenyl)methyl]sulfanyl}-5-{4-[(propan-2-yl)oxy]phenyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Compound characteristics
| Compound ID: | D271-0218 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-5-{4-[(propan-2-yl)oxy]phenyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione |
| Molecular Weight: | 455.96 |
| Molecular Formula: | C23 H22 Cl N3 O3 S |
| Smiles: | CC(C)Oc1ccc(cc1)C1CC(NC2=C1C(NC(=N2)SCc1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8161 |
| logD: | 3.8062 |
| logSw: | -4.451 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.671 |
| InChI Key: | PIIHVGMNJDGJBU-GOSISDBHSA-N |