5-amino-N-(2,5-dimethylphenyl)-1-[2-(4-ethylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(2,5-dimethylphenyl)-1-[2-(4-ethylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(2,5-dimethylphenyl)-1-[2-(4-ethylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E919-2698 |
| Compound Name: | 5-amino-N-(2,5-dimethylphenyl)-1-[2-(4-ethylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C21 H24 N6 O2 |
| Smiles: | CCc1ccc(cc1)NC(Cn1c(c(C(Nc2cc(C)ccc2C)=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8588 |
| logD: | 2.8588 |
| logSw: | -3.0122 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 91.739 |
| InChI Key: | PZRJLEBVJJRTNY-UHFFFAOYSA-N |