2-[2-(butoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Chemical Structure Depiction of
2-[2-(butoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-[2-(butoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Compound characteristics
Compound ID: | 0627-0165 |
Compound Name: | 2-[2-(butoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid |
Molecular Weight: | 367.36 |
Molecular Formula: | C20 H17 N O6 |
Smiles: | CCCCOC(c1ccccc1N1C(c2ccc(cc2C1=O)C(O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.382 |
logD: | 0.4044 |
logSw: | -4.1562 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.035 |
InChI Key: | DAVOHDIXNYPOHO-UHFFFAOYSA-N |