2-methyl-3-nitro-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide
Chemical Structure Depiction of
2-methyl-3-nitro-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide
2-methyl-3-nitro-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | 4334-0158 |
| Compound Name: | 2-methyl-3-nitro-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]benzamide |
| Molecular Weight: | 401.38 |
| Molecular Formula: | C22 H15 N3 O5 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(Nc1ccc(cc1)C1=Nc2ccccc2C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7581 |
| logD: | 3.7431 |
| logSw: | -4.1984 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.357 |
| InChI Key: | FRGUWNSDNBOUOA-UHFFFAOYSA-N |