N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y500-7668 |
| Compound Name: | N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 452.25 |
| Molecular Formula: | C18 H13 Cl2 F2 N7 O |
| Smiles: | Cc1cc(C(F)F)n2c(n1)nc(C(Nc1cnn(Cc3ccc(cc3[Cl])[Cl])c1)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.9989 |
| logD: | 2.9979 |
| logSw: | -3.4461 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.456 |
| InChI Key: | HWRIHVHWJJJQIP-UHFFFAOYSA-N |