N-(3-chloro-4-cyanophenyl)-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-cyanophenyl)-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-(3-chloro-4-cyanophenyl)-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y508-9658 |
| Compound Name: | N-(3-chloro-4-cyanophenyl)-7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 362.72 |
| Molecular Formula: | C15 H9 Cl F2 N6 O |
| Smiles: | Cc1cc(C(F)F)n2c(n1)nc(C(Nc1ccc(C#N)c(c1)[Cl])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.2872 |
| logD: | 2.1578 |
| logSw: | -3.5821 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.006 |
| InChI Key: | QLEPCGGHKNEJNF-UHFFFAOYSA-N |