ethyl 4-(2-{5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamido)benzoate
ethyl 4-(2-{5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | 8016-6678 |
| Compound Name: | ethyl 4-(2-{5-[3-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamido)benzoate |
| Molecular Weight: | 419.36 |
| Molecular Formula: | C19 H16 F3 N5 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC(Cn1nc(c2cccc(c2)C(F)(F)F)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.202 |
| logD: | 4.2019 |
| logSw: | -4.3052 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.245 |
| InChI Key: | JOOHHKNKJGYSEQ-UHFFFAOYSA-N |