N-(4-chloro-2,5-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
N-(4-chloro-2,5-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
N-(4-chloro-2,5-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | 8015-0856 |
| Compound Name: | N-(4-chloro-2,5-dimethoxyphenyl)-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 282.68 |
| Molecular Formula: | C11 H11 Cl N4 O3 |
| Smiles: | COc1cc(c(cc1NC(c1nc[nH]n1)=O)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.226 |
| logD: | 0.9225 |
| logSw: | -2.5624 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.596 |
| InChI Key: | GRJKDPNJFNGLRL-UHFFFAOYSA-N |