N-(2,4-dimethoxyphenyl)-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
N-(2,4-dimethoxyphenyl)-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
Compound characteristics
| Compound ID: | 8018-2390 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide |
| Molecular Weight: | 315.29 |
| Molecular Formula: | C13 H13 N7 O3 |
| Smiles: | COc1ccc(c(c1)OC)NC(c1nc([nH]n1)n1cnnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5124 |
| logD: | 0.4676 |
| logSw: | -2.0587 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.821 |
| InChI Key: | DHXIBHOLNYVOMJ-UHFFFAOYSA-N |