4-chloro-3-nitro-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Chemical Structure Depiction of
4-chloro-3-nitro-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
4-chloro-3-nitro-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Compound characteristics
| Compound ID: | 2255-1549 |
| Compound Name: | 4-chloro-3-nitro-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide |
| Molecular Weight: | 389.71 |
| Molecular Formula: | C16 H8 Cl N3 O7 |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[N+]([O-])=O)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8817 |
| logD: | 2.4342 |
| logSw: | -3.8481 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.677 |
| InChI Key: | WMYAFBNUBWXRSI-UHFFFAOYSA-N |