5-hydroxy-2-{[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzoic acid
Chemical Structure Depiction of
5-hydroxy-2-{[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzoic acid
5-hydroxy-2-{[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzoic acid
Compound characteristics
Compound ID: | 4334-0987 |
Compound Name: | 5-hydroxy-2-{[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzoic acid |
Molecular Weight: | 382.37 |
Molecular Formula: | C20 H18 N2 O6 |
Smiles: | CC(C)CN1C(c2ccc(cc2C1=O)C(Nc1ccc(cc1C(O)=O)O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0021 |
logD: | -1.5527 |
logSw: | -3.3478 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 98.182 |
InChI Key: | VFQNSAZJDHBFCQ-UHFFFAOYSA-N |