N-(2-bromo-4-methylphenyl)-N~2~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycinamide
Chemical Structure Depiction of
N-(2-bromo-4-methylphenyl)-N~2~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycinamide
N-(2-bromo-4-methylphenyl)-N~2~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycinamide
Compound characteristics
| Compound ID: | K889-1419 |
| Compound Name: | N-(2-bromo-4-methylphenyl)-N~2~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycinamide |
| Molecular Weight: | 489.39 |
| Molecular Formula: | C21 H21 Br N4 O3 S |
| Smiles: | Cc1ccc(c(c1)[Br])NC(CNC(CN1C=Nc2c(C1=O)c1CCCCc1s2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3914 |
| logD: | 3.3914 |
| logSw: | -3.9457 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.085 |
| InChI Key: | ZDNAAXIIEOFMNW-UHFFFAOYSA-N |