2-[5-cyano-2-(4-fluorophenyl)-6-oxopyrimidin-1(6H)-yl]-N-(3,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[5-cyano-2-(4-fluorophenyl)-6-oxopyrimidin-1(6H)-yl]-N-(3,5-dimethoxyphenyl)acetamide
2-[5-cyano-2-(4-fluorophenyl)-6-oxopyrimidin-1(6H)-yl]-N-(3,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | M045-0300 |
| Compound Name: | 2-[5-cyano-2-(4-fluorophenyl)-6-oxopyrimidin-1(6H)-yl]-N-(3,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 408.39 |
| Molecular Formula: | C21 H17 F N4 O4 |
| Smiles: | COc1cc(cc(c1)OC)NC(CN1C(c2ccc(cc2)F)=NC=C(C#N)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5755 |
| logD: | 2.5754 |
| logSw: | -3.0293 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.632 |
| InChI Key: | COXMJUBETAXNEC-UHFFFAOYSA-N |