5-amino-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | E919-1476 |
Compound Name: | 5-amino-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-N-(3,4-dimethylphenyl)-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 424.46 |
Molecular Formula: | C21 H24 N6 O4 |
Smiles: | Cc1ccc(cc1C)NC(c1c(N)n(CC(Nc2ccc(c(c2)OC)OC)=O)nn1)=O |
Stereo: | ACHIRAL |
logP: | 2.2111 |
logD: | 2.211 |
logSw: | -2.8944 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 107.698 |
InChI Key: | SEHYNPUHCQHJRH-UHFFFAOYSA-N |