4-({2-[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}methyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-({2-[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}methyl)cyclohexane-1-carboxylic acid
4-({2-[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}methyl)cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y041-2275 |
| Compound Name: | 4-({2-[(6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}methyl)cyclohexane-1-carboxylic acid |
| Molecular Weight: | 469.92 |
| Molecular Formula: | C25 H24 Cl N O6 |
| Smiles: | C1C[C@H](CC[C@@H]1C(O)=O)CNC(COc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5559 |
| logD: | 0.9956 |
| logSw: | -3.8491 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.76 |
| InChI Key: | HAVINGMAQNEKHR-UHFFFAOYSA-N |