3-(4-bromo-3-nitrophenyl)-N-[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
Chemical Structure Depiction of
3-(4-bromo-3-nitrophenyl)-N-[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
3-(4-bromo-3-nitrophenyl)-N-[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
Compound characteristics
| Compound ID: | 0957-0046 |
| Compound Name: | 3-(4-bromo-3-nitrophenyl)-N-[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine |
| Molecular Weight: | 517.16 |
| Molecular Formula: | C22 H12 Br Cl2 N3 O3 |
| Smiles: | C(=C/c1ccc(c(c1)[N+]([O-])=O)[Br])\C=N/c1ccc2c(c1)nc(c1cc(ccc1[Cl])[Cl])o2 |
| Stereo: | ACHIRAL |
| logP: | 7.0373 |
| logD: | 7.0372 |
| logSw: | -7.0014 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.888 |
| InChI Key: | WUOBQAOAAGJHGR-UHFFFAOYSA-N |