N-(2-bromo-4-methylphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(2-bromo-4-methylphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
N-(2-bromo-4-methylphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 1988-0937 |
| Compound Name: | N-(2-bromo-4-methylphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 358.19 |
| Molecular Formula: | C17 H12 Br N O3 |
| Smiles: | Cc1ccc(c(c1)[Br])NC(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8574 |
| logD: | 3.8406 |
| logSw: | -4.043 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.554 |
| InChI Key: | HRRDZHZNDHQHSS-UHFFFAOYSA-N |