2-(4-chloro-2,5-dimethoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Chemical Structure Depiction of
2-(4-chloro-2,5-dimethoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-(4-chloro-2,5-dimethoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Compound characteristics
Compound ID: | 1606-0102 |
Compound Name: | 2-(4-chloro-2,5-dimethoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid |
Molecular Weight: | 361.74 |
Molecular Formula: | C17 H12 Cl N O6 |
Smiles: | COc1cc(c(cc1N1C(c2ccc(cc2C1=O)C(O)=O)=O)OC)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.6315 |
logD: | -0.3461 |
logSw: | -3.9507 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.248 |
InChI Key: | BBBLGNDYZZMVSP-UHFFFAOYSA-N |