(1r,4r)-4-({2-[(2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
(1r,4r)-4-({2-[(2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
(1r,4r)-4-({2-[(2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y041-2286 |
| Compound Name: | (1r,4r)-4-({2-[(2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid |
| Molecular Weight: | 373.4 |
| Molecular Formula: | C20 H23 N O6 |
| Smiles: | CC(C(NC[C@@H]1CC[C@H](CC1)C(O)=O)=O)Oc1ccc2C=CC(=O)Oc2c1 |
| Stereo: | ABSOLUTE |
| logP: | 1.8834 |
| logD: | -0.677 |
| logSw: | -2.4413 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.448 |
| InChI Key: | SCMRAVQXCAHESR-OPFPJEHXSA-N |