N-(2-methylphenyl)-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-methylphenyl)-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
N-(2-methylphenyl)-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 4408-0100 |
| Compound Name: | N-(2-methylphenyl)-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 439.6 |
| Molecular Formula: | C23 H25 N3 O2 S2 |
| Smiles: | CC(=C)CN1C(=Nc2c(C1=O)c1CCCCc1s2)SCC(Nc1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7792 |
| logD: | 4.7792 |
| logSw: | -4.5166 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.317 |
| InChI Key: | ACIMAEYFDVCLHV-UHFFFAOYSA-N |