2-{[3-(3,3-diethoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
Chemical Structure Depiction of
2-{[3-(3,3-diethoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
2-{[3-(3,3-diethoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
Compound characteristics
| Compound ID: | K263-0739 |
| Compound Name: | 2-{[3-(3,3-diethoxypropyl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(3-methoxypropyl)acetamide |
| Molecular Weight: | 493.64 |
| Molecular Formula: | C23 H31 N3 O5 S2 |
| Smiles: | CCOC(CCN1C(=Nc2c3ccccc3sc2C1=O)SCC(NCCCOC)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 2.7494 |
| logD: | 2.7494 |
| logSw: | -3.008 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.097 |
| InChI Key: | DGGRPHCMPHIYLO-UHFFFAOYSA-N |