N-(3-chloro-2-methylphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-(3-chloro-2-methylphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | J093-0053 |
Compound Name: | N-(3-chloro-2-methylphenyl)-5-(4-fluorophenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 449.79 |
Molecular Formula: | C20 H12 Cl F4 N5 O |
Smiles: | Cc1c(cccc1[Cl])NC(c1nc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 5.4476 |
logD: | 5.4461 |
logSw: | -6.0402 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.174 |
InChI Key: | HTZHYNRPDUPUFN-UHFFFAOYSA-N |