4-bromo-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Chemical Structure Depiction of
4-bromo-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
4-bromo-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Compound characteristics
| Compound ID: | 2255-1557 |
| Compound Name: | 4-bromo-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide |
| Molecular Weight: | 389.16 |
| Molecular Formula: | C16 H9 Br N2 O5 |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[N+]([O-])=O)NC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5005 |
| logD: | 3.4469 |
| logSw: | -3.9002 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.596 |
| InChI Key: | PLCYSCVVACXMSB-UHFFFAOYSA-N |