ethyl 3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-carboxylate
Chemical Structure Depiction of
ethyl 3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-carboxylate
ethyl 3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-carboxylate
Compound characteristics
| Compound ID: | 8020-8257 |
| Compound Name: | ethyl 3-(4-methoxyphenyl)-1H-1,2,4-triazole-5-carboxylate |
| Molecular Weight: | 247.25 |
| Molecular Formula: | C12 H13 N3 O3 |
| Smiles: | CCOC(c1nc(c2ccc(cc2)OC)n[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4526 |
| logD: | 1.8387 |
| logSw: | -2.7132 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.321 |
| InChI Key: | MKXAPKYEPDRRCT-UHFFFAOYSA-N |