5-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-2-{[(4-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Chemical Structure Depiction of
5-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-2-{[(4-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
5-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-2-{[(4-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Compound characteristics
| Compound ID: | D392-0085 |
| Compound Name: | 5-{3-methoxy-4-[(prop-2-en-1-yl)oxy]phenyl}-2-{[(4-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | Cc1ccc(CSC2NC(C3C(CC(NC=3N=2)=O)c2ccc(c(c2)OC)OCC=C)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1233 |
| logD: | 3.1135 |
| logSw: | -3.3067 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.003 |
| InChI Key: | IRVYDMHEFHPQAV-GOSISDBHSA-N |