4-(quinoxalin-2-yl)phenyl 3,5-dinitrobenzoate
Chemical Structure Depiction of
4-(quinoxalin-2-yl)phenyl 3,5-dinitrobenzoate
4-(quinoxalin-2-yl)phenyl 3,5-dinitrobenzoate
Compound characteristics
| Compound ID: | 8001-5173 |
| Compound Name: | 4-(quinoxalin-2-yl)phenyl 3,5-dinitrobenzoate |
| Molecular Weight: | 416.35 |
| Molecular Formula: | C21 H12 N4 O6 |
| Smiles: | c1ccc2c(c1)ncc(c1ccc(cc1)OC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.6405 |
| logD: | 4.6405 |
| logSw: | -4.8332 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 104.562 |
| InChI Key: | LNRWSTYTALBJQM-UHFFFAOYSA-N |