5-(3,5-difluorophenyl)-1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
5-(3,5-difluorophenyl)-1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
5-(3,5-difluorophenyl)-1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D271-0620 |
| Compound Name: | 5-(3,5-difluorophenyl)-1-methyl-2-{[(4-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 427.47 |
| Molecular Formula: | C22 H19 F2 N3 O2 S |
| Smiles: | Cc1ccc(CSC2=NC(C3C(CC(NC=3N2C)=O)c2cc(cc(c2)F)F)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1674 |
| logD: | 3.0674 |
| logSw: | -3.2349 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.082 |
| InChI Key: | BCLKLSUXCAPOEZ-KRWDZBQOSA-N |