2-(1,3-benzoxazol-2-yl)-4-nitrophenyl 2,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-(1,3-benzoxazol-2-yl)-4-nitrophenyl 2,4-dichlorobenzene-1-sulfonate
2-(1,3-benzoxazol-2-yl)-4-nitrophenyl 2,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-2747 |
| Compound Name: | 2-(1,3-benzoxazol-2-yl)-4-nitrophenyl 2,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 465.27 |
| Molecular Formula: | C19 H10 Cl2 N2 O6 S |
| Salt: | not_available |
| Smiles: | c1ccc2c(c1)nc(c1cc(ccc1OS(c1ccc(cc1[Cl])[Cl])(=O)=O)[N+]([O-])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.3427 |
| logD: | 5.3427 |
| logSw: | -6.0548 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.278 |
| InChI Key: | AGJREDOTAJMGBX-UHFFFAOYSA-N |