1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5-{2-[(propan-2-yl)oxy]phenyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5-{2-[(propan-2-yl)oxy]phenyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5-{2-[(propan-2-yl)oxy]phenyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D271-0553 |
| Compound Name: | 1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5-{2-[(propan-2-yl)oxy]phenyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | CC(C)Oc1ccccc1C1CC(NC2=C1C(N=C(N2C)SCc1ccc(C)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6751 |
| logD: | 3.575 |
| logSw: | -3.8726 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.971 |
| InChI Key: | IBWOQBYKICNSAR-IBGZPJMESA-N |