4-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
Chemical Structure Depiction of
4-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
4-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid
Compound characteristics
| Compound ID: | D715-2877 |
| Compound Name: | 4-{2-[(4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy]acetamido}butanoic acid |
| Molecular Weight: | 319.31 |
| Molecular Formula: | C16 H17 N O6 |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)OCC(NCCCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1596 |
| logD: | -2.6613 |
| logSw: | -2.2079 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.842 |
| InChI Key: | RFRPVICVZFRKIJ-UHFFFAOYSA-N |