N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-methyl-3-nitrobenzamide
N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8170-0481 |
| Compound Name: | N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-2-methyl-3-nitrobenzamide |
| Molecular Weight: | 421.84 |
| Molecular Formula: | C22 H16 Cl N3 O4 |
| Smiles: | Cc1ccc2c(c1)oc(c1ccc(c(c1)NC(c1cccc(c1C)[N+]([O-])=O)=O)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 5.6905 |
| logD: | 5.64 |
| logSw: | -5.9067 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.523 |
| InChI Key: | PFZAJUDZQZFVJS-UHFFFAOYSA-N |