(2,5-dimethylphenyl)methyl 1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(2,5-dimethylphenyl)methyl 1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
(2,5-dimethylphenyl)methyl 1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | F152-0637 |
| Compound Name: | (2,5-dimethylphenyl)methyl 1-(3-fluorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 339.37 |
| Molecular Formula: | C19 H18 F N3 O2 |
| Smiles: | Cc1ccc(C)c(COC(c2c(C)n(c3cccc(c3)F)nn2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0826 |
| logD: | 4.0826 |
| logSw: | -4.2379 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.939 |
| InChI Key: | HTOUOKLRTULYAB-UHFFFAOYSA-N |