5-ethyl-1-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
5-ethyl-1-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
5-ethyl-1-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0087 |
| Compound Name: | 5-ethyl-1-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 247.25 |
| Molecular Formula: | C12 H13 N3 O3 |
| Smiles: | CCc1c(C(O)=O)nnn1c1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 1.4943 |
| logD: | -4.3919 |
| logSw: | -1.9192 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.544 |
| InChI Key: | BCWKDNYJVPMGPG-UHFFFAOYSA-N |