2-{[(4-fluorophenyl)methyl]sulfanyl}-5-(3-hydroxy-4-methoxyphenyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]sulfanyl}-5-(3-hydroxy-4-methoxyphenyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
2-{[(4-fluorophenyl)methyl]sulfanyl}-5-(3-hydroxy-4-methoxyphenyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione
Compound characteristics
| Compound ID: | D392-0818 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]sulfanyl}-5-(3-hydroxy-4-methoxyphenyl)-1-methyl-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(1H,6H)-dione |
| Molecular Weight: | 441.48 |
| Molecular Formula: | C22 H20 F N3 O4 S |
| Smiles: | CN1C2=C(C(CC(N2)=O)c2ccc(c(c2)O)OC)C(N=C1SCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.956 |
| logD: | 1.8559 |
| logSw: | -2.7568 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.26 |
| InChI Key: | TYOXJLXPWOFQGW-HNNXBMFYSA-N |