5-(2-chloroanilino)-N-(2,5-diethoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-(2-chloroanilino)-N-(2,5-diethoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
5-(2-chloroanilino)-N-(2,5-diethoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-0852 |
| Compound Name: | 5-(2-chloroanilino)-N-(2,5-diethoxyphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 401.85 |
| Molecular Formula: | C19 H20 Cl N5 O3 |
| Smiles: | CCOc1ccc(c(c1)NC(c1c(Nc2ccccc2[Cl])[nH]nn1)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.7124 |
| logD: | 3.6465 |
| logSw: | -3.9368 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.493 |
| InChI Key: | RRUSGCWOTNRYKJ-UHFFFAOYSA-N |