1-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
1-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0128 |
| Compound Name: | 1-(3,4-dimethoxyphenyl)-5-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 355.35 |
| Molecular Formula: | C18 H17 N3 O5 |
| Smiles: | COc1cccc(c1)c1c(C(O)=O)nnn1c1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0888 |
| logD: | -3.8864 |
| logSw: | -2.3274 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.052 |
| InChI Key: | OWVFMRCGCQALLG-UHFFFAOYSA-N |