3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid)
TL;DR: 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) (CAS 420105-10-8) is a chemical compound with molecular formula C33H20N2O9 and molecular weight 588.12 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-dioxoisoindole-5-carbonyl]-1,3-dioxoisoindol-2-yl]-4-methylbenzoic acid
Also Known As: 3,3'-(5,5'-carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid), 3,3'-[carbonylbis(1,3-dioxo-1,3-dihydro-2H-isoindole-5,2-diyl)]bis(4-methylbenzoic acid), 3-[5-[2-(5-carboxy-2-methylphenyl)-1,3-dioxoisoindole-5-carbonyl]-1,3-dioxoisoindol-2-yl]-4-methylbenzoic acid, 3-{5-[2-(5-CARBOXY-2-METHYLPHENYL)-1,3-DIOXOISOINDOLE-5-CARBONYL]-1,3-DIOXOISOINDOL-2-YL}-4-METHYLBENZOIC ACID
| Molecular Formula | C33H20N2O9 |
|---|---|
| Molecular Weight | 588.12 g/mol |
| LogP | 4.53204 |
| Topological Polar Surface Area | 166.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 588.1169 |
| Heavy Atoms | 44 |
| Complexity | 1915.425 |
Chemical Identifiers
| CAS Number | 420105-10-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=C(C=CC(=C6)C(=O)O)C |
Product Overview
3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) (CAS 420105-10-8), with molecular formula C33H20N2O9 and molecular weight 588.12 g/mol. IUPAC: 3-[5-[2-(5-carboxy-2-methylphenyl)-1,3-dioxoisoindole-5-carbonyl]-1,3-dioxoisoindol-2-yl]-4-methylbenzoic acid.
Chemical Property Profile of 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid)
Property Insights of 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid)
The XLogP value of 4.53204 indicates that 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 166.43 Ų indicates high polarity, suggesting 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) has 2 hydrogen bond donor(s) and 7 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'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid)?
The CAS number of 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) is 420105-10-8.
What is the molecular formula of 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid)?
The molecular formula of 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) is C33H20N2O9.
What is the molecular weight of 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid)?
The molecular weight of 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) is 588.12 g/mol.
Where can I buy 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid)?
You can request a quote for 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-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'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-(5,5'-Carbonylbis(1,3-dioxoisoindoline-5,2-diyl))bis(4-methylbenzoic acid) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.