N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methoxy-3-nitrobenzamide
N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | 4402-0360 |
| Compound Name: | N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-4-methoxy-3-nitrobenzamide |
| Molecular Weight: | 403.39 |
| Molecular Formula: | C22 H17 N3 O5 |
| Smiles: | Cc1c(cccc1NC(c1ccc(c(c1)[N+]([O-])=O)OC)=O)c1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 4.352 |
| logD: | 4.3518 |
| logSw: | -4.4608 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.153 |
| InChI Key: | SWNIADKITULBJT-UHFFFAOYSA-N |