3-bromo-N-[3-methyl-4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
Chemical Structure Depiction of
3-bromo-N-[3-methyl-4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
3-bromo-N-[3-methyl-4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | 2153-0094 |
| Compound Name: | 3-bromo-N-[3-methyl-4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide |
| Molecular Weight: | 434.29 |
| Molecular Formula: | C23 H16 Br N O3 |
| Smiles: | Cc1cc(ccc1C1=Cc2ccccc2OC1=O)NC(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4639 |
| logD: | 5.4606 |
| logSw: | -5.6133 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.98 |
| InChI Key: | LOTNYNXYYOMSJN-UHFFFAOYSA-N |