N-[(2-chlorophenyl)methyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-[(2-chlorophenyl)methyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | J093-0228 |
Compound Name: | N-[(2-chlorophenyl)methyl]-5-(4-methoxyphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 461.83 |
Molecular Formula: | C21 H15 Cl F3 N5 O2 |
Smiles: | COc1ccc(cc1)c1cc(C(F)(F)F)n2c(n1)nc(C(NCc1ccccc1[Cl])=O)n2 |
Stereo: | ACHIRAL |
logP: | 4.8502 |
logD: | 4.8502 |
logSw: | -4.9986 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.738 |
InChI Key: | DNTFTYASQYSWEN-UHFFFAOYSA-N |