4-({2-[(6-ethyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}methyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-({2-[(6-ethyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}methyl)cyclohexane-1-carboxylic acid
4-({2-[(6-ethyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}methyl)cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y041-2274 |
| Compound Name: | 4-({2-[(6-ethyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetamido}methyl)cyclohexane-1-carboxylic acid |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C27 H29 N O6 |
| Smiles: | CCc1cc2C(=CC(=O)Oc2cc1OCC(NC[C@H]1CC[C@@H](CC1)C(O)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6308 |
| logD: | 1.0705 |
| logSw: | -3.8743 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.76 |
| InChI Key: | KNBGYUXCXDOOSX-UHFFFAOYSA-N |