4-nitro-N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Chemical Structure Depiction of
4-nitro-N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
4-nitro-N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Compound characteristics
| Compound ID: | 1989-9391 |
| Compound Name: | 4-nitro-N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide |
| Molecular Weight: | 355.26 |
| Molecular Formula: | C16 H9 N3 O7 |
| Smiles: | C1=C(C(=O)Oc2c1cccc2[N+]([O-])=O)NC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7096 |
| logD: | 2.7 |
| logSw: | -3.3557 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.361 |
| InChI Key: | ARLBMOXREALSAQ-UHFFFAOYSA-N |