1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5-[4-(2-methylpropoxy)phenyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5-[4-(2-methylpropoxy)phenyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5-[4-(2-methylpropoxy)phenyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D392-0641 |
| Compound Name: | 1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5-[4-(2-methylpropoxy)phenyl]-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 463.6 |
| Molecular Formula: | C26 H29 N3 O3 S |
| Smiles: | CC(C)COc1ccc(cc1)C1CC(NC2=C1C(N=C(N2C)SCc1ccccc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8418 |
| logD: | 4.7418 |
| logSw: | -4.4532 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.581 |
| InChI Key: | UFJCVLPPUKVEPR-NRFANRHFSA-N |