5-amino-N-(3,5-dimethylphenyl)-1-[2-(2-ethoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-N-(3,5-dimethylphenyl)-1-[2-(2-ethoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-N-(3,5-dimethylphenyl)-1-[2-(2-ethoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C368-0807 |
| Compound Name: | 5-amino-N-(3,5-dimethylphenyl)-1-[2-(2-ethoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | CCOc1ccccc1NC(Cn1c(c(C(Nc2cc(C)cc(C)c2)=O)nn1)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5563 |
| logD: | 2.5563 |
| logSw: | -2.844 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 98.949 |
| InChI Key: | VARPCLKWHRRJBM-UHFFFAOYSA-N |