4-acetamidophenyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
4-acetamidophenyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
4-acetamidophenyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 3720-3277 |
| Compound Name: | 4-acetamidophenyl 6-bromo-2-oxo-2H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 402.2 |
| Molecular Formula: | C18 H12 Br N O5 |
| Smiles: | CC(Nc1ccc(cc1)OC(C1=Cc2cc(ccc2OC1=O)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0607 |
| logD: | 3.0607 |
| logSw: | -3.4827 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.8 |
| InChI Key: | FTZBKSXISWDOEG-UHFFFAOYSA-N |