![3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) structure](/static/products/4208/420841-29-8.webp)
3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid)
TL;DR: 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) (CAS 420841-29-8) is a chemical compound with molecular formula C32H20N2O8 and molecular weight 560.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[2-(5-carboxy-2-methylphenyl)-1,3-dioxoisoindol-5-yl]-1,3-dioxoisoindol-2-yl]-4-methylbenzoic acid
Also Known As: 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid), 3,3'-(1,1',3,3'-tetraoxo-1,1',3,3'-tetrahydro-2H,2'H-5,5'-biisoindole-2,2'-diyl)bis(4-methylbenzoic acid), 3-[5-[2-(5-carboxy-2-methylphenyl)-1,3-dioxoisoindol-5-yl]-1,3-dioxoisoindol-2-yl]-4-methylbenzoic acid
| Molecular Formula | C32H20N2O8 |
|---|---|
| Molecular Weight | 560.12 g/mol |
| LogP | 4.96804 |
| Topological Polar Surface Area | 149.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 560.12195 |
| Heavy Atoms | 42 |
| Complexity | 1817.3315 |
Chemical Identifiers
| CAS Number | 420841-29-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=C(C=CC(=C6)C(=O)O)C |
Product Overview
3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) (CAS 420841-29-8), with molecular formula C32H20N2O8 and molecular weight 560.12 g/mol. IUPAC: 3-[5-[2-(5-carboxy-2-methylphenyl)-1,3-dioxoisoindol-5-yl]-1,3-dioxoisoindol-2-yl]-4-methylbenzoic acid.
Chemical Property Profile of 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid)
Property Insights of 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid)
The XLogP value of 4.96804 indicates that 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.36 Ų indicates high polarity, suggesting 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid)?
The CAS number of 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) is 420841-29-8.
What is the molecular formula of 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid)?
The molecular formula of 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) is C32H20N2O8.
What is the molecular weight of 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid)?
The molecular weight of 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) is 560.12 g/mol.
Where can I buy 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid)?
You can request a quote for 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-(1,1',3,3'-tetraoxo-[5,5'-biisoindoline]-2,2'-diyl)bis(4-methylbenzoic acid) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.