2-chloro-N-[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide
2-chloro-N-[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | 2154-0378 |
| Compound Name: | 2-chloro-N-[2-methyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrobenzamide |
| Molecular Weight: | 421.84 |
| Molecular Formula: | C22 H16 Cl N3 O4 |
| Smiles: | Cc1ccc2c(c1)nc(c1cccc(c1C)NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.5409 |
| logD: | 5.5379 |
| logSw: | -5.9601 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.824 |
| InChI Key: | IGGNXXXPDFLMBY-UHFFFAOYSA-N |