4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid
TL;DR: 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid (CAS 378778-12-2) is a chemical compound with molecular formula C23H15NO9S and molecular weight 481.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[4-(carboxymethoxy)phenyl]-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid
Also Known As: 4-((2-(4-(carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid, 4-[2-[4-(carboxymethoxy)phenyl]-1,3-dioxo-isoindol-5-yl]sulfonylbenzoic Acid, 4-[2-[4-(carboxymethyloxy)phenyl]-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid, 4-({2-[4-(carboxymethoxy)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}sulfonyl)benzoic acid
| Molecular Formula | C23H15NO9S |
|---|---|
| Molecular Weight | 481.05 g/mol |
| LogP | 2.4816 |
| Topological Polar Surface Area | 155.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 481.04675 |
| Heavy Atoms | 34 |
| Complexity | 1442.7611 |
Chemical Identifiers
| CAS Number | 378778-12-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)OCC(=O)O |
Product Overview
4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid (CAS 378778-12-2), with molecular formula C23H15NO9S and molecular weight 481.05 g/mol. IUPAC: 4-[2-[4-(carboxymethoxy)phenyl]-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid.
Chemical Property Profile of 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid
Property Insights of 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid
The XLogP value of 2.4816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid. The TPSA of 155.35 Ų indicates high polarity, suggesting 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid has 2 hydrogen bond donor(s) and 7 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-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid?
The CAS number of 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid is 378778-12-2.
What is the molecular formula of 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid?
The molecular formula of 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid is C23H15NO9S.
What is the molecular weight of 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid?
The molecular weight of 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid is 481.05 g/mol.
Where can I buy 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid?
You can request a quote for 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((2-(4-(Carboxymethoxy)phenyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.