2-{[3-(1-benzylpiperidin-4-yl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-cyclopentylacetamide
Chemical Structure Depiction of
2-{[3-(1-benzylpiperidin-4-yl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-cyclopentylacetamide
2-{[3-(1-benzylpiperidin-4-yl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-cyclopentylacetamide
Compound characteristics
| Compound ID: | K263-0652 |
| Compound Name: | 2-{[3-(1-benzylpiperidin-4-yl)-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-cyclopentylacetamide |
| Molecular Weight: | 532.73 |
| Molecular Formula: | C29 H32 N4 O2 S2 |
| Smiles: | C1CCC(C1)NC(CSC1=Nc2c3ccccc3sc2C(N1C1CCN(CC1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2096 |
| logD: | 4.4761 |
| logSw: | -5.5329 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.591 |
| InChI Key: | ORQAOAQDWPIGMF-UHFFFAOYSA-N |