ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate
ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
Compound ID: | C513-0025 |
Compound Name: | ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate |
Molecular Weight: | 304.3 |
Molecular Formula: | C14 H16 N4 O4 |
Smiles: | CCOC(c1cn(CC(Nc2cccc(c2)OC)=O)nn1)=O |
Stereo: | ACHIRAL |
logP: | 1.5742 |
logD: | 1.5741 |
logSw: | -2.2191 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.198 |
InChI Key: | FYVNQLMXUXYLBZ-UHFFFAOYSA-N |