6-bromo-N-(2-methylphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-(2-methylphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
6-bromo-N-(2-methylphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 2222-0870 |
| Compound Name: | 6-bromo-N-(2-methylphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 358.19 |
| Molecular Formula: | C17 H12 Br N O3 |
| Smiles: | Cc1ccccc1NC(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6101 |
| logD: | 3.6078 |
| logSw: | -3.7715 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.554 |
| InChI Key: | FPDWINVTVNSHHS-UHFFFAOYSA-N |