5-amino-1-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | E919-1562 |
Compound Name: | 5-amino-1-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-[(2-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 408.46 |
Molecular Formula: | C21 H24 N6 O3 |
Smiles: | Cc1ccc(C)c(c1)NC(Cn1c(c(C(NCc2ccccc2OC)=O)nn1)N)=O |
Stereo: | ACHIRAL |
logP: | 1.5425 |
logD: | 1.5425 |
logSw: | -2.305 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 100.692 |
InChI Key: | PCYLQUMBHNWYEN-UHFFFAOYSA-N |