2-bromo-N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
Chemical Structure Depiction of
2-bromo-N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
2-bromo-N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | 2072-0780 |
| Compound Name: | 2-bromo-N-[2-(2-chloro-5-iodophenyl)-1,3-benzoxazol-5-yl]-5-nitrobenzamide |
| Molecular Weight: | 598.58 |
| Molecular Formula: | C20 H10 Br Cl I N3 O4 |
| Smiles: | c1cc2c(cc1NC(c1cc(ccc1[Br])[N+]([O-])=O)=O)nc(c1cc(ccc1[Cl])I)o2 |
| Stereo: | ACHIRAL |
| logP: | 7.0083 |
| logD: | 6.8829 |
| logSw: | -6.8018 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | IXBWELWKUJDPMQ-UHFFFAOYSA-N |