methyl 2-(2-{5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamido)benzoate
methyl 2-(2-{5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | 8017-4946 |
| Compound Name: | methyl 2-(2-{5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamido)benzoate |
| Molecular Weight: | 405.33 |
| Molecular Formula: | C18 H14 F3 N5 O3 |
| Smiles: | COC(c1ccccc1NC(Cn1nc(c2ccc(cc2)C(F)(F)F)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3962 |
| logD: | 3.3889 |
| logSw: | -3.7485 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.967 |
| InChI Key: | IFKVVTYFZVRENX-UHFFFAOYSA-N |