2-({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-methoxyphenyl)butanamide
Chemical Structure Depiction of
2-({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-methoxyphenyl)butanamide
2-({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-methoxyphenyl)butanamide
Compound characteristics
| Compound ID: | K263-0765 |
| Compound Name: | 2-({3-[(2-chlorophenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-(3-methoxyphenyl)butanamide |
| Molecular Weight: | 550.1 |
| Molecular Formula: | C28 H24 Cl N3 O3 S2 |
| Smiles: | CCC(C(Nc1cccc(c1)OC)=O)SC1=Nc2c3ccccc3sc2C(N1Cc1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.099 |
| logD: | 7.099 |
| logSw: | -6.4353 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.172 |
| InChI Key: | KWNQECCZCVOQBJ-QFIPXVFZSA-N |