N-(4-fluorophenyl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(4-fluorophenyl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P032-1940 |
| Compound Name: | N-(4-fluorophenyl)-2-[7-(methoxymethyl)-3-oxo-5-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 407.4 |
| Molecular Formula: | C21 H18 F N5 O3 |
| Smiles: | COCC1=CC2=NN(CC(Nc3ccc(cc3)F)=O)C(N2C(c2ccccc2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6772 |
| logD: | 2.6562 |
| logSw: | -3.1183 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.904 |
| InChI Key: | WIXKVBQYSNLWJO-UHFFFAOYSA-N |