N-(2-chloro-4-fluorophenyl)-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-chloro-4-fluorophenyl)-N~2~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycinamide
N-(2-chloro-4-fluorophenyl)-N~2~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycinamide
Compound characteristics
| Compound ID: | K889-1435 |
| Compound Name: | N-(2-chloro-4-fluorophenyl)-N~2~-[(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]glycinamide |
| Molecular Weight: | 448.9 |
| Molecular Formula: | C20 H18 Cl F N4 O3 S |
| Smiles: | C1CCc2c(C1)c1C(N(CC(NCC(Nc3ccc(cc3[Cl])F)=O)=O)C=Nc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0432 |
| logD: | 3.0352 |
| logSw: | -3.7897 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.085 |
| InChI Key: | ZBWWFLNMYLQIFY-UHFFFAOYSA-N |