3-(4-bromo-3-nitrophenyl)-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]prop-2-en-1-imine
Chemical Structure Depiction of
3-(4-bromo-3-nitrophenyl)-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]prop-2-en-1-imine
3-(4-bromo-3-nitrophenyl)-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]prop-2-en-1-imine
Compound characteristics
| Compound ID: | 0957-0049 |
| Compound Name: | 3-(4-bromo-3-nitrophenyl)-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]prop-2-en-1-imine |
| Molecular Weight: | 462.3 |
| Molecular Formula: | C23 H16 Br N3 O3 |
| Smiles: | Cc1ccc2c(c1)nc(c1cccc(c1)/N=C/C=C/c1ccc(c(c1)[N+]([O-])=O)[Br])o2 |
| Stereo: | ACHIRAL |
| logP: | 6.1572 |
| logD: | 6.1571 |
| logSw: | -5.7163 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.888 |
| InChI Key: | OXGCBMWRHWUEEE-UHFFFAOYSA-N |