5-bromo-2-chloro-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
Chemical Structure Depiction of
5-bromo-2-chloro-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
5-bromo-2-chloro-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | 2154-0040 |
| Compound Name: | 5-bromo-2-chloro-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide |
| Molecular Weight: | 454.71 |
| Molecular Formula: | C22 H13 Br Cl N O3 |
| Smiles: | C1=C(C(=O)Oc2ccccc12)c1ccc(cc1)NC(c1cc(ccc1[Cl])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5712 |
| logD: | 5.5302 |
| logSw: | -6.0152 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.98 |
| InChI Key: | DITKRXXAFANHCM-UHFFFAOYSA-N |