4-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
Chemical Structure Depiction of
4-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
4-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
Compound characteristics
| Compound ID: | D715-0516 |
| Compound Name: | 4-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid |
| Molecular Weight: | 423.46 |
| Molecular Formula: | C24 H25 N O6 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OCC(NCCCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6949 |
| logD: | -0.126 |
| logSw: | -3.113 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.855 |
| InChI Key: | UOYRCTDQBSFTNI-UHFFFAOYSA-N |