5-(3,4-dihydroxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Chemical Structure Depiction of
5-(3,4-dihydroxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
5-(3,4-dihydroxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione
Compound characteristics
| Compound ID: | D271-0014 |
| Compound Name: | 5-(3,4-dihydroxyphenyl)-2-{[(4-fluorophenyl)methyl]sulfanyl}-5,8-dihydropyrido[2,3-d]pyrimidine-4,7(3H,6H)-dione |
| Molecular Weight: | 413.43 |
| Molecular Formula: | C20 H16 F N3 O4 S |
| Smiles: | C1C(C2=C(NC1=O)N=C(NC2=O)SCc1ccc(cc1)F)c1ccc(c(c1)O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2359 |
| logD: | 1.2182 |
| logSw: | -2.2601 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 90.965 |
| InChI Key: | ZMUARTVOFVBMHW-CYBMUJFWSA-N |