2-{[3-(3-ethoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{[3-(3-ethoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
2-{[3-(3-ethoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | K263-0489 |
| Compound Name: | 2-{[3-(3-ethoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 495.66 |
| Molecular Formula: | C26 H29 N3 O3 S2 |
| Smiles: | CCOCCCN1C(=Nc2c3ccccc3sc2C1=O)SCC(Nc1ccc(cc1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7719 |
| logD: | 5.7719 |
| logSw: | -5.6381 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.643 |
| InChI Key: | HOLFSYMDRWNJJH-UHFFFAOYSA-N |