2-{[3-(4-fluorophenyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-{[3-(4-fluorophenyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
2-{[3-(4-fluorophenyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | C280-1072 |
| Compound Name: | 2-{[3-(4-fluorophenyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 455.57 |
| Molecular Formula: | C23 H22 F N3 O2 S2 |
| Smiles: | CC1CC2=C(C(N(C(=N2)SCC(NCCc2ccccc2)=O)c2ccc(cc2)F)=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1509 |
| logD: | 3.1508 |
| logSw: | -3.3995 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.809 |
| InChI Key: | LAEVHAPHKGNKJQ-HNNXBMFYSA-N |