4-bromo-N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]benzamide
4-bromo-N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]benzamide
Compound characteristics
| Compound ID: | C301-9505 |
| Compound Name: | 4-bromo-N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]benzamide |
| Molecular Weight: | 441.32 |
| Molecular Formula: | C22 H21 Br N2 O3 |
| Smiles: | C1CCC(CC1)NC1=C(C(=O)Oc2ccccc12)NC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7938 |
| logD: | 3.5085 |
| logSw: | -4.8636 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.609 |
| InChI Key: | ZXHMKAYAXCWPRH-UHFFFAOYSA-N |