5-methyl-4-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylic acid
Chemical Structure Depiction of
5-methyl-4-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylic acid
5-methyl-4-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylic acid
Compound characteristics
| Compound ID: | 4986-1233 |
| Compound Name: | 5-methyl-4-{[(2-oxo-4-propyl-2H-1-benzopyran-7-yl)oxy]methyl}furan-2-carboxylic acid |
| Molecular Weight: | 342.35 |
| Molecular Formula: | C19 H18 O6 |
| Smiles: | CCCC1=CC(=O)Oc2cc(ccc12)OCc1cc(C(O)=O)oc1C |
| Stereo: | ACHIRAL |
| logP: | 3.0691 |
| logD: | -0.2212 |
| logSw: | -3.2048 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.607 |
| InChI Key: | OQBSCTPZFDQQEF-UHFFFAOYSA-N |