1-(4-fluorobenzoyl)-3-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]azepan-2-one
Chemical Structure Depiction of
1-(4-fluorobenzoyl)-3-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]azepan-2-one
1-(4-fluorobenzoyl)-3-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]azepan-2-one
Compound characteristics
| Compound ID: | 5055-7731 |
| Compound Name: | 1-(4-fluorobenzoyl)-3-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]azepan-2-one |
| Molecular Weight: | 455.57 |
| Molecular Formula: | C23 H22 F N3 O2 S2 |
| Smiles: | C1CCN(C(C(C1)Sc1c2c3CCCCc3sc2ncn1)=O)C(c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8577 |
| logD: | 4.8577 |
| logSw: | -5.1097 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.633 |
| InChI Key: | GFWRUVSJQIIHNC-SFHVURJKSA-N |