N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-nitrobenzamide
N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | 2080-0353 |
| Compound Name: | N-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-nitrobenzamide |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C21 H15 N3 O5 |
| Smiles: | COc1ccc(cc1NC(c1ccccc1[N+]([O-])=O)=O)c1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 4.2459 |
| logD: | 4.1435 |
| logSw: | -4.4801 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.153 |
| InChI Key: | MGRCRXOSKHSCBC-UHFFFAOYSA-N |