N-(2-chloro-4-fluorophenyl)-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
N-(2-chloro-4-fluorophenyl)-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L459-0486 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-2-{[4-oxo-6-phenyl-3-(prop-2-en-1-yl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 485.99 |
| Molecular Formula: | C23 H17 Cl F N3 O2 S2 |
| Smiles: | C=CCN1C(=Nc2cc(c3ccccc3)sc2C1=O)SCC(Nc1ccc(cc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4945 |
| logD: | 5.4895 |
| logSw: | -5.9362 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.219 |
| InChI Key: | GRNKGLAZBKQCCK-UHFFFAOYSA-N |