4-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
Chemical Structure Depiction of
4-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
4-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
Compound characteristics
| Compound ID: | D715-0450 |
| Compound Name: | 4-{2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C17 H19 N O6 |
| Smiles: | CC1=C(C)c2ccc(cc2OC1=O)OCC(NCCCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6824 |
| logD: | -2.1385 |
| logSw: | -2.2423 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.356 |
| InChI Key: | XIMGYEOAJWRIJF-UHFFFAOYSA-N |