1,3-dioxo-2-{4-[(pyridin-4-yl)methyl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxylic acid
Chemical Structure Depiction of
1,3-dioxo-2-{4-[(pyridin-4-yl)methyl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxylic acid
1,3-dioxo-2-{4-[(pyridin-4-yl)methyl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxylic acid
Compound characteristics
Compound ID: | 6415-0258 |
Compound Name: | 1,3-dioxo-2-{4-[(pyridin-4-yl)methyl]phenyl}-2,3-dihydro-1H-isoindole-5-carboxylic acid |
Molecular Weight: | 358.35 |
Molecular Formula: | C21 H14 N2 O4 |
Smiles: | C(c1ccc(cc1)N1C(c2ccc(cc2C1=O)C(O)=O)=O)c1ccncc1 |
Stereo: | ACHIRAL |
logP: | 3.1248 |
logD: | -0.8527 |
logSw: | -3.1186 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.445 |
InChI Key: | IHIOMYIUXDASKW-UHFFFAOYSA-N |