dimethyl 5-{[3-(pyrrolidin-1-yl)quinoxaline-2-carbonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[3-(pyrrolidin-1-yl)quinoxaline-2-carbonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[3-(pyrrolidin-1-yl)quinoxaline-2-carbonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | G934-0040 |
| Compound Name: | dimethyl 5-{[3-(pyrrolidin-1-yl)quinoxaline-2-carbonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 434.45 |
| Molecular Formula: | C23 H22 N4 O5 |
| Smiles: | COC(c1cc(cc(c1)NC(c1c(nc2ccccc2n1)N1CCCC1)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6128 |
| logD: | 4.6079 |
| logSw: | -4.4016 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.132 |
| InChI Key: | JVKDZWFEHPKTHJ-UHFFFAOYSA-N |