4-(quinoxalin-2-yl)phenyl 2-nitrobenzene-1-sulfonate
Chemical Structure Depiction of
4-(quinoxalin-2-yl)phenyl 2-nitrobenzene-1-sulfonate
4-(quinoxalin-2-yl)phenyl 2-nitrobenzene-1-sulfonate
Compound characteristics
| Compound ID: | 0584-0149 |
| Compound Name: | 4-(quinoxalin-2-yl)phenyl 2-nitrobenzene-1-sulfonate |
| Molecular Weight: | 407.4 |
| Molecular Formula: | C20 H13 N3 O5 S |
| Smiles: | c1ccc(c(c1)[N+]([O-])=O)S(=O)(=O)Oc1ccc(cc1)c1cnc2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3675 |
| logD: | 4.3675 |
| logSw: | -4.5381 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.264 |
| InChI Key: | VKMMXBNPZGLPQY-UHFFFAOYSA-N |