4-methyl-3-nitro-N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Chemical Structure Depiction of
4-methyl-3-nitro-N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
4-methyl-3-nitro-N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Compound characteristics
| Compound ID: | 2125-0504 |
| Compound Name: | 4-methyl-3-nitro-N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide |
| Molecular Weight: | 369.29 |
| Molecular Formula: | C17 H11 N3 O7 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(NC1=Cc2cccc(c2OC1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1321 |
| logD: | 3.0314 |
| logSw: | -3.4983 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.06 |
| InChI Key: | SMKPEVOZFNOQGA-UHFFFAOYSA-N |