4-[(2-{[4-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamido)methyl]cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
4-[(2-{[4-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamido)methyl]cyclohexane-1-carboxylic acid
4-[(2-{[4-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamido)methyl]cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y041-2251 |
| Compound Name: | 4-[(2-{[4-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamido)methyl]cyclohexane-1-carboxylic acid |
| Molecular Weight: | 465.5 |
| Molecular Formula: | C26 H27 N O7 |
| Smiles: | COc1ccc(cc1)C1=CC(=O)Oc2cc(ccc12)OCC(NC[C@H]1CC[C@@H](CC1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5945 |
| logD: | 0.0341 |
| logSw: | -3.0594 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.217 |
| InChI Key: | ZMGPMCNHOUGQGK-UHFFFAOYSA-N |