3-(4-bromo-3-nitrophenyl)-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
Chemical Structure Depiction of
3-(4-bromo-3-nitrophenyl)-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
3-(4-bromo-3-nitrophenyl)-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
Compound characteristics
| Compound ID: | 0957-0047 |
| Compound Name: | 3-(4-bromo-3-nitrophenyl)-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine |
| Molecular Weight: | 504.38 |
| Molecular Formula: | C26 H22 Br N3 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc2cc(ccc2o1)/N=C/C=C/c1ccc(c(c1)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 7.6761 |
| logD: | 7.6761 |
| logSw: | -5.809 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.888 |
| InChI Key: | LWTQGODVCMMFMH-UHFFFAOYSA-N |