N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-methyl-4-nitrobenzamide
N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-methyl-4-nitrobenzamide
Compound characteristics
| Compound ID: | F019-0087 |
| Compound Name: | N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-3-methyl-4-nitrobenzamide |
| Molecular Weight: | 389.37 |
| Molecular Formula: | C21 H15 N3 O5 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(Nc1ccc(c(c1)c1nc2ccccc2o1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3949 |
| logD: | 5.3946 |
| logSw: | -5.1435 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.769 |
| InChI Key: | YZLXMECEUPSKFR-UHFFFAOYSA-N |