Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate
TL;DR: Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate (CAS 681458-91-3) is a chemical compound with molecular formula C17H12N2O6 and molecular weight 340.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate
Also Known As: dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate, dimethyl 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)pyridine-
| Molecular Formula | C17H12N2O6 |
|---|---|
| Molecular Weight | 340.07 g/mol |
| LogP | 1.4554 |
| Topological Polar Surface Area | 102.87 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.06955 |
| Heavy Atoms | 25 |
| Complexity | 851.8541 |
Chemical Identifiers
| CAS Number | 681458-91-3 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC(=N1)C(=O)OC)N2C(=O)C3=CC=CC=C3C2=O |
Product Overview
Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate (CAS 681458-91-3), with molecular formula C17H12N2O6 and molecular weight 340.07 g/mol. IUPAC: dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate.
Chemical Property Profile of Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate
Property Insights of Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate
The XLogP value of 1.4554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate. The TPSA of 102.87 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate has 0 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 Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate?
The CAS number of Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate is 681458-91-3.
What is the molecular formula of Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate?
The molecular formula of Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate is C17H12N2O6.
What is the molecular weight of Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate?
The molecular weight of Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate is 340.07 g/mol.
Where can I buy Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate?
You can request a quote for Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 4-(1,3-dioxoisoindol-2-yl)pyridine-2,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.