2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3-nitrobenzamide
Chemical Structure Depiction of
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3-nitrobenzamide
2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-1419 |
| Compound Name: | 2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-3-nitrobenzamide |
| Molecular Weight: | 261.23 |
| Molecular Formula: | C12 H11 N3 O4 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(Nc1cc(C)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8038 |
| logD: | 0.8896 |
| logSw: | -3.6374 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.206 |
| InChI Key: | MNSSQQJWADCNIJ-UHFFFAOYSA-N |