N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | K802-0435 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 455.92 |
| Molecular Formula: | C22 H18 Cl N3 O4 S |
| Smiles: | COc1cc(c(cc1NC(CN1C=Nc2c(C1=O)c(cs2)c1ccccc1)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.8134 |
| logD: | 3.8078 |
| logSw: | -4.528 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.682 |
| InChI Key: | DXUJLFVYLDHQHE-UHFFFAOYSA-N |