1-(4-methoxyphenyl)-N-[2-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-(4-methoxyphenyl)-N-[2-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxamide
1-(4-methoxyphenyl)-N-[2-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | D296-0172 |
Compound Name: | 1-(4-methoxyphenyl)-N-[2-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 378.31 |
Molecular Formula: | C17 H13 F3 N4 O3 |
Smiles: | COc1ccc(cc1)n1cc(C(Nc2ccccc2OC(F)(F)F)=O)nn1 |
Stereo: | ACHIRAL |
logP: | 4.0449 |
logD: | 3.8728 |
logSw: | -4.2927 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.564 |
InChI Key: | NXLKJFVLHAMQCZ-UHFFFAOYSA-N |