4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid
TL;DR: 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid (CAS 296792-19-3) is a chemical compound with molecular formula C20H12N2O6S and molecular weight 408.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid
Also Known As: 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid, 4-(1,3-dioxo-2-pyridin-4-yl-isoindol-5-yl)sulfonylbenzoic Acid, 4-((1,3-dioxo-2-(pyridin-4-yl)isoindolin-5-yl)sulfonyl)benzoic acid, 4-{[1,3-DIOXO-2-(4-PYRIDYL)-2,3-DIHYDRO-1H-ISOINDOL-5-YL]SULFONYL}BENZOIC ACID, 4-{[1,3-dioxo-2-(pyridin-4-yl)-2,3-dihydro-1H-isoindol-5-yl]sulfonyl}benzoic acid
| Molecular Formula | C20H12N2O6S |
|---|---|
| Molecular Weight | 408.04 g/mol |
| LogP | 2.4132 |
| Topological Polar Surface Area | 121.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.0416 |
| Heavy Atoms | 29 |
| Complexity | 1268.0834 |
Chemical Identifiers
| CAS Number | 296792-19-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=NC=C4 |
Product Overview
4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid (CAS 296792-19-3), with molecular formula C20H12N2O6S and molecular weight 408.04 g/mol. IUPAC: 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid.
Chemical Property Profile of 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid
Property Insights of 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid
The XLogP value of 2.4132 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid. The TPSA of 121.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid. Following Lipinski's Rule of Five, 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid?
The CAS number of 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid is 296792-19-3.
What is the molecular formula of 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid?
The molecular formula of 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid is C20H12N2O6S.
What is the molecular weight of 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid?
The molecular weight of 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid is 408.04 g/mol.
Where can I buy 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid?
You can request a quote for 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-dioxo-2-pyridin-4-ylisoindol-5-yl)sulfonylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.