4-[2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)butanamide
Chemical Structure Depiction of
4-[2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)butanamide
4-[2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)butanamide
Compound characteristics
| Compound ID: | K292-1307 |
| Compound Name: | 4-[2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)butanamide |
| Molecular Weight: | 516.06 |
| Molecular Formula: | C25 H23 Cl F N3 O2 S2 |
| Smiles: | C(CC(NCCc1ccccc1)=O)CN1C(=Nc2ccsc2C1=O)SCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 4.5526 |
| logD: | 4.5526 |
| logSw: | -4.5797 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.081 |
| InChI Key: | VIZMADVQEVYDNE-UHFFFAOYSA-N |