2-({3-[2-(3,4-dimethoxyphenyl)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-(3,4-dimethoxyphenyl)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-(3,4-dimethoxyphenyl)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: | K263-0407 |
| Compound Name: | 2-({3-[2-(3,4-dimethoxyphenyl)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: | 571.72 |
| Molecular Formula: | C31 H29 N3 O4 S2 |
| Smiles: | COc1ccc(CCN2C(=Nc3c4ccccc4sc3C2=O)SCC(N(CC=C)c2ccccc2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.6745 |
| logD: | 5.6745 |
| logSw: | -5.7064 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.85 |
| InChI Key: | OGZJZKFOXKGDMN-UHFFFAOYSA-N |