N-(3-methoxyphenyl)-2-({4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)butanamide
Chemical Structure Depiction of
N-(3-methoxyphenyl)-2-({4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)butanamide
N-(3-methoxyphenyl)-2-({4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)butanamide
Compound characteristics
| Compound ID: | K263-0708 |
| Compound Name: | N-(3-methoxyphenyl)-2-({4-oxo-3-[(oxolan-2-yl)methyl]-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)butanamide |
| Molecular Weight: | 509.65 |
| Molecular Formula: | C26 H27 N3 O4 S2 |
| Smiles: | CCC(C(Nc1cccc(c1)OC)=O)SC1=Nc2c3ccccc3sc2C(N1CC1CCCO1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0578 |
| logD: | 5.0578 |
| logSw: | -4.8799 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.827 |
| InChI Key: | PCHQCGOMMFCYJI-UHFFFAOYSA-N |