1-(2-fluoro-4-methylphenyl)-5-propyl-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(2-fluoro-4-methylphenyl)-5-propyl-1H-1,2,3-triazole-4-carboxylic acid
1-(2-fluoro-4-methylphenyl)-5-propyl-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0422 |
| Compound Name: | 1-(2-fluoro-4-methylphenyl)-5-propyl-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 263.27 |
| Molecular Formula: | C13 H14 F N3 O2 |
| Smiles: | CCCc1c(C(O)=O)nnn1c1ccc(C)cc1F |
| Stereo: | ACHIRAL |
| logP: | 2.2686 |
| logD: | -3.6176 |
| logSw: | -2.2511 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.699 |
| InChI Key: | WQRVKWMONLPIGC-UHFFFAOYSA-N |