5-(3-bromo-4-fluorophenyl)-1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
5-(3-bromo-4-fluorophenyl)-1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
5-(3-bromo-4-fluorophenyl)-1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D392-0637 |
| Compound Name: | 5-(3-bromo-4-fluorophenyl)-1-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 488.38 |
| Molecular Formula: | C22 H19 Br F N3 O2 S |
| Smiles: | Cc1ccccc1CSC1=NC(C2C(CC(NC=2N1C)=O)c1ccc(c(c1)[Br])F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2368 |
| logD: | 4.1367 |
| logSw: | -4.2335 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.082 |
| InChI Key: | YMVQFCDYUPJKNF-HNNXBMFYSA-N |