(1r,4r)-4-({2-[(3-hexyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
Chemical Structure Depiction of
(1r,4r)-4-({2-[(3-hexyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
(1r,4r)-4-({2-[(3-hexyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid
Compound characteristics
| Compound ID: | Y042-9670 |
| Compound Name: | (1r,4r)-4-({2-[(3-hexyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]propanamido}methyl)cyclohexane-1-carboxylic acid |
| Molecular Weight: | 485.62 |
| Molecular Formula: | C28 H39 N O6 |
| Smiles: | CCCCCCC1=C(C)c2ccc(c(C)c2OC1=O)OC(C)C(NC[C@H]1CC[C@@H](CC1)C(O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 5.941 |
| logD: | 3.3807 |
| logSw: | -5.2757 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.734 |
| InChI Key: | UGEYFXNCYJMMDU-MWXLCCTBSA-N |