N~3~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]-N-(propan-2-yl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]-N-(propan-2-yl)-beta-alaninamide
N~3~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]-N-(propan-2-yl)-beta-alaninamide
Compound characteristics
| Compound ID: | C046-0069 |
| Compound Name: | N~3~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]-N-(propan-2-yl)-beta-alaninamide |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C18 H24 N4 O3 S |
| Smiles: | CC(C)NC(CCNC(CN1C=Nc2c(C1=O)c1CCCCc1s2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8121 |
| logD: | 0.8121 |
| logSw: | -1.7517 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.192 |
| InChI Key: | KWIZMKHHBWCAJT-UHFFFAOYSA-N |