N-(2-chloro-4-methylphenyl)-2-[5-methyl-3-oxo-7-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-[5-methyl-3-oxo-7-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(2-chloro-4-methylphenyl)-2-[5-methyl-3-oxo-7-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P032-2357 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-[5-methyl-3-oxo-7-(pyridin-4-yl)[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 408.85 |
| Molecular Formula: | C20 H17 Cl N6 O2 |
| Smiles: | CC1=NC(=CC2=NN(CC(Nc3ccc(C)cc3[Cl])=O)C(N12)=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5137 |
| logD: | 2.495 |
| logSw: | -3.3421 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.869 |
| InChI Key: | USVXFFXPMGJMNP-UHFFFAOYSA-N |