2-({3-[2-(diethylamino)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-phenyl-N-(prop-2-en-1-yl)acetamide
Chemical Structure Depiction of
2-({3-[2-(diethylamino)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-phenyl-N-(prop-2-en-1-yl)acetamide
2-({3-[2-(diethylamino)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-phenyl-N-(prop-2-en-1-yl)acetamide
Compound characteristics
| Compound ID: | K263-0302 |
| Compound Name: | 2-({3-[2-(diethylamino)ethyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-phenyl-N-(prop-2-en-1-yl)acetamide |
| Molecular Weight: | 506.69 |
| Molecular Formula: | C27 H30 N4 O2 S2 |
| Smiles: | CCN(CC)CCN1C(=Nc2c3ccccc3sc2C1=O)SCC(N(CC=C)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1719 |
| logD: | 3.0971 |
| logSw: | -5.1277 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.272 |
| InChI Key: | DMCSIGZFIGEEOE-UHFFFAOYSA-N |