N-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)-3,4-dimethylbenzamide
Chemical Structure Depiction of
N-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)-3,4-dimethylbenzamide
N-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)-3,4-dimethylbenzamide
Compound characteristics
| Compound ID: | 2255-1630 |
| Compound Name: | N-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)-3,4-dimethylbenzamide |
| Molecular Weight: | 372.22 |
| Molecular Formula: | C18 H14 Br N O3 |
| Smiles: | Cc1ccc(cc1C)C(NC1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4268 |
| logD: | 4.2855 |
| logSw: | -4.4056 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.215 |
| InChI Key: | VOBUXQADTVQYHM-UHFFFAOYSA-N |