2-bromo-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
Chemical Structure Depiction of
2-bromo-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
2-bromo-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | 2072-0783 |
| Compound Name: | 2-bromo-N-[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide |
| Molecular Weight: | 494.34 |
| Molecular Formula: | C24 H20 Br N3 O4 |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc2cc(ccc2o1)NC(c1cc(ccc1[Br])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7653 |
| logD: | 6.64 |
| logSw: | -5.6771 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | IVPNEGRTOHCCSI-UHFFFAOYSA-N |