3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-7-[4-(pyridin-2-yl)piperazine-1-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-7-[4-(pyridin-2-yl)piperazine-1-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-7-[4-(pyridin-2-yl)piperazine-1-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | C301-1108 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-7-[4-(pyridin-2-yl)piperazine-1-carbonyl]-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 513.55 |
| Molecular Formula: | C28 H27 N5 O5 |
| Smiles: | COc1ccc(cc1OC)C(/C=C1/C(Nc2cc(ccc2N1)C(N1CCN(CC1)c1ccccn1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8415 |
| logD: | 2.6955 |
| logSw: | -3.447 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.031 |
| InChI Key: | OFRKNKCVUVYBFM-UHFFFAOYSA-N |