N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-3-(trifluoromethyl)aniline
Chemical Structure Depiction of
N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-3-(trifluoromethyl)aniline
N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-3-(trifluoromethyl)aniline
Compound characteristics
| Compound ID: | J034-0653 |
| Compound Name: | N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-3-(trifluoromethyl)aniline |
| Molecular Weight: | 389.42 |
| Molecular Formula: | C20 H22 F3 N5 |
| Smiles: | CCC(C)(c1nnnn1c1c(C)cccc1C)Nc1cccc(c1)C(F)(F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.854 |
| logD: | 5.854 |
| logSw: | -5.7873 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.691 |
| InChI Key: | IUJJREBIRNJKRU-IBGZPJMESA-N |