1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate
TL;DR: 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate (CAS 111148-57-3) is a chemical compound with molecular formula C23H12N2O6 and molecular weight 412.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,3-dioxoisoindol-2-yl) 3-(1,3-dioxoisoindol-2-yl)benzoate
Also Known As: 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate, A1811/0076536, 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)benzoate, (1,3-dioxoisoindol-2-yl) 3-(1,3-dioxoisoindol-2-yl)benzoate, 2-(3-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]carbonyl}phenyl)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C23H12N2O6 |
|---|---|
| Molecular Weight | 412.07 g/mol |
| LogP | 2.8552 |
| Topological Polar Surface Area | 101.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.06955 |
| Heavy Atoms | 31 |
| Complexity | 1258.9019 |
Chemical Identifiers
| CAS Number | 111148-57-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=CC(=C3)C(=O)ON4C(=O)C5=CC=CC=C5C4=O |
Product Overview
1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate (CAS 111148-57-3), with molecular formula C23H12N2O6 and molecular weight 412.07 g/mol. IUPAC: (1,3-dioxoisoindol-2-yl) 3-(1,3-dioxoisoindol-2-yl)benzoate.
Chemical Property Profile of 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate
Property Insights of 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate
The XLogP value of 2.8552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate. The TPSA of 101.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate. Following Lipinski's Rule of Five, 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate has 0 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 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate?
The CAS number of 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate is 111148-57-3.
What is the molecular formula of 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate?
The molecular formula of 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate is C23H12N2O6.
What is the molecular weight of 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate?
The molecular weight of 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate is 412.07 g/mol.
Where can I buy 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate?
You can request a quote for 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxoisoindolin-2-yl 3-(1,3-dioxoisoindolin-2-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.