6-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamido]hexanoic acid
Chemical Structure Depiction of
6-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamido]hexanoic acid
6-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamido]hexanoic acid
Compound characteristics
| Compound ID: | Y041-2130 |
| Compound Name: | 6-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-1-benzopyran-3-yl)propanamido]hexanoic acid |
| Molecular Weight: | 375.42 |
| Molecular Formula: | C20 H25 N O6 |
| Smiles: | CC1=C(CCC(NCCCCCC(O)=O)=O)C(=O)Oc2c1ccc(c2C)O |
| Stereo: | ACHIRAL |
| logP: | 1.5761 |
| logD: | -1.2521 |
| logSw: | -2.2653 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.089 |
| InChI Key: | RQFNAYWPMHJGMI-UHFFFAOYSA-N |