7-bromo-N-[2-(dimethylamino)-2-(5-methylfuran-2-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
7-bromo-N-[2-(dimethylamino)-2-(5-methylfuran-2-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide
7-bromo-N-[2-(dimethylamino)-2-(5-methylfuran-2-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D491-8099 |
| Compound Name: | 7-bromo-N-[2-(dimethylamino)-2-(5-methylfuran-2-yl)ethyl]-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 455.73 |
| Molecular Formula: | C19 H19 Br N2 O4 |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccc(C)o1)N(C)C)C(C1=CC(c2ccc(cc2O1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3042 |
| logD: | 2.5251 |
| logSw: | -3.8139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.904 |
| InChI Key: | VZVNMSOXKIIVMW-AWEZNQCLSA-N |