2-bromo-N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
Chemical Structure Depiction of
2-bromo-N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
2-bromo-N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | 2152-0358 |
| Compound Name: | 2-bromo-N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide |
| Molecular Weight: | 490.67 |
| Molecular Formula: | C20 H10 Br Cl F N3 O4 |
| Smiles: | c1cc2c(cc1NC(c1cc(ccc1[Br])[N+]([O-])=O)=O)nc(c1ccc(cc1[Cl])F)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.589 |
| logD: | 5.4637 |
| logSw: | -6.1191 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | AFUTWXFDIDFHOX-UHFFFAOYSA-N |