5-(pyridin-4-yl)-1-[3-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
5-(pyridin-4-yl)-1-[3-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
5-(pyridin-4-yl)-1-[3-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0351 |
| Compound Name: | 5-(pyridin-4-yl)-1-[3-(trifluoromethoxy)phenyl]-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 350.25 |
| Molecular Formula: | C15 H9 F3 N4 O3 |
| Smiles: | c1cc(cc(c1)OC(F)(F)F)n1c(c2ccncc2)c(C(O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.321 |
| logD: | -3.6542 |
| logSw: | -2.2664 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.612 |
| InChI Key: | MFYCAEMVJCWPLT-UHFFFAOYSA-N |