[3-(trifluoromethyl)phenyl]methyl 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
[3-(trifluoromethyl)phenyl]methyl 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
[3-(trifluoromethyl)phenyl]methyl 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | F152-0623 |
| Compound Name: | [3-(trifluoromethyl)phenyl]methyl 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 440.22 |
| Molecular Formula: | C18 H13 Br F3 N3 O2 |
| Smiles: | Cc1c(C(=O)OCc2cccc(c2)C(F)(F)F)nnn1c1ccccc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.3261 |
| logD: | 4.3261 |
| logSw: | -4.6147 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.638 |
| InChI Key: | IZMDTNHZTRSJMJ-UHFFFAOYSA-N |