1-[(2-fluorophenyl)methyl]-5-methyl-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-[(2-fluorophenyl)methyl]-5-methyl-1H-1,2,3-triazole-4-carboxylic acid
1-[(2-fluorophenyl)methyl]-5-methyl-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0596 |
| Compound Name: | 1-[(2-fluorophenyl)methyl]-5-methyl-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 235.21 |
| Molecular Formula: | C11 H10 F N3 O2 |
| Smiles: | Cc1c(C(O)=O)nnn1Cc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 1.0432 |
| logD: | -3.0336 |
| logSw: | -1.7365 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.353 |
| InChI Key: | PEZVCFWVWVKLMD-UHFFFAOYSA-N |