N-[(4-fluorophenyl)methyl]-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
N-[(4-fluorophenyl)methyl]-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P573-6366 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-2-[7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 406.42 |
| Molecular Formula: | C21 H19 F N6 O2 |
| Smiles: | Cc1ccc(cc1)NC1C=CN2C(N=1)=NN(CC(NCc1ccc(cc1)F)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | 2.8263 |
| logD: | 2.8258 |
| logSw: | -3.2706 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.317 |
| InChI Key: | MPAVUAMPGQTMJW-UHFFFAOYSA-N |