![4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid structure](/static/products/6674/667409-83-8.webp)
4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid
TL;DR: 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid (CAS 667409-83-8) is a chemical compound with molecular formula C20H13NO7S and molecular weight 411.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid
Also Known As: 4-[2-(furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid, 4-[2-(2-furfuryl)-1,3-diketo-isoindolin-5-yl]sulfonylbenzoic acid, 4-{[2-(2-furylmethyl)-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl]sulfonyl}benzoic acid, 4-((2-(furan-2-ylmethyl)-1,3-dioxoisoindolin-5-yl)sulfonyl)benzoic acid, 4-[[2-(2-furanylmethyl)-1,3-dioxo-5-isoindolyl]sulfonyl]benzoic acid
| Molecular Formula | C20H13NO7S |
|---|---|
| Molecular Weight | 411.04 g/mol |
| LogP | 2.6068 |
| Topological Polar Surface Area | 121.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.04126 |
| Heavy Atoms | 29 |
| Complexity | 1242.4917 |
Chemical Identifiers
| CAS Number | 667409-83-8 |
|---|---|
| SMILES | C1=COC(=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)O |
Product Overview
4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid (CAS 667409-83-8), with molecular formula C20H13NO7S and molecular weight 411.04 g/mol. IUPAC: 4-[2-(furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid.
Chemical Property Profile of 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid
Property Insights of 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid
The XLogP value of 2.6068 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid. The TPSA of 121.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid. Following Lipinski's Rule of Five, 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-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-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid?
The CAS number of 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid is 667409-83-8.
What is the molecular formula of 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid?
The molecular formula of 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid is C20H13NO7S.
What is the molecular weight of 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid?
The molecular weight of 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid is 411.04 g/mol.
Where can I buy 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid?
You can request a quote for 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-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-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(Furan-2-ylmethyl)-1,3-dioxoisoindol-5-yl]sulfonylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.