N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-chloro-4-nitrobenzamide
Chemical Structure Depiction of
N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-chloro-4-nitrobenzamide
N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-chloro-4-nitrobenzamide
Compound characteristics
| Compound ID: | 4671-0511 |
| Compound Name: | N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-chloro-4-nitrobenzamide |
| Molecular Weight: | 423.81 |
| Molecular Formula: | C21 H14 Cl N3 O5 |
| Smiles: | COc1ccc(cc1NC(c1ccc(cc1[Cl])[N+]([O-])=O)=O)c1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 5.0331 |
| logD: | 5.0279 |
| logSw: | -5.328 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.454 |
| InChI Key: | UIEHGPPIDBOGSJ-UHFFFAOYSA-N |