N-(2,4-dimethylphenyl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
N-(2,4-dimethylphenyl)-2-[7-(4-fluoroanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P573-6706 |
| Compound Name: | N-(2,4-dimethylphenyl)-2-[7-(4-fluoroanilino)-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(c(C)c1)NC(CN1C(N2C=CC(Nc3ccc(cc3)F)=NC2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3078 |
| logD: | 3.3053 |
| logSw: | -3.404 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.297 |
| InChI Key: | ZRRMEIXKLYLLQA-UHFFFAOYSA-N |