2-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-3-oxo-N-phenyl-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Chemical Structure Depiction of
2-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-3-oxo-N-phenyl-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
2-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-3-oxo-N-phenyl-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
Compound characteristics
Compound ID: | C301-1106 |
Compound Name: | 2-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-3-oxo-N-phenyl-1,2,3,4-tetrahydroquinoxaline-6-carboxamide |
Molecular Weight: | 443.46 |
Molecular Formula: | C25 H21 N3 O5 |
Smiles: | COc1ccc(cc1OC)C(/C=C1/C(Nc2cc(ccc2N1)C(Nc1ccccc1)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3499 |
logD: | 3.2127 |
logSw: | -3.7223 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 87.703 |
InChI Key: | UJJMYCCXJPYTKS-UHFFFAOYSA-N |