N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide
N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2239-0564 |
| Compound Name: | N-[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide |
| Molecular Weight: | 407.81 |
| Molecular Formula: | C21 H14 Cl N3 O4 |
| Smiles: | Cc1ccc2c(c1)nc(c1cc(ccc1[Cl])NC(c1cccc(c1)[N+]([O-])=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.451 |
| logD: | 5.4385 |
| logSw: | -5.9404 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.521 |
| InChI Key: | RDRPJOVPQGXTBZ-UHFFFAOYSA-N |