Dibutyl pyridine-2,6-dicarboxylate
TL;DR: Dibutyl pyridine-2,6-dicarboxylate (CAS 41727-17-7) is a chemical compound with molecular formula C15H21NO4 and molecular weight 279.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibutyl pyridine-2,6-dicarboxylate
Also Known As: Dibutyl pyridine-2,6-dicarboxylate, 2,6-Dibutyl 2,6-pyridinedicarboxylate, DIBUTYL 2,6-PYRIDINEDICARBOXYLATE, pyridine-2,6-dicarboxylic acid dibutyl ester, DIBUTYL 2,6-PYRIDINEDICARBOXYLATE, 99
| Molecular Formula | C15H21NO4 |
|---|---|
| Molecular Weight | 279.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 65.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 279.14706 |
| Heavy Atoms | 20 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 41727-17-7 |
|---|---|
| SMILES | CCCCOC(=O)C1=NC(=CC=C1)C(=O)OCCCC |
| InChIKey | SJGUKBIVRJZPJZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibutyl pyridine-2,6-dicarboxylate (CAS 41727-17-7), with molecular formula C15H21NO4 and molecular weight 279.15 g/mol. IUPAC: dibutyl pyridine-2,6-dicarboxylate.
Chemical Property Profile of Dibutyl pyridine-2,6-dicarboxylate
Property Insights of Dibutyl pyridine-2,6-dicarboxylate
The XLogP value of 3.7 indicates that Dibutyl pyridine-2,6-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibutyl pyridine-2,6-dicarboxylate. Following Lipinski's Rule of Five, Dibutyl pyridine-2,6-dicarboxylate has 0 hydrogen bond donor(s) and 5 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 Dibutyl pyridine-2,6-dicarboxylate?
The CAS number of Dibutyl pyridine-2,6-dicarboxylate is 41727-17-7.
What is the molecular formula of Dibutyl pyridine-2,6-dicarboxylate?
The molecular formula of Dibutyl pyridine-2,6-dicarboxylate is C15H21NO4.
What is the molecular weight of Dibutyl pyridine-2,6-dicarboxylate?
The molecular weight of Dibutyl pyridine-2,6-dicarboxylate is 279.15 g/mol.
Where can I buy Dibutyl pyridine-2,6-dicarboxylate?
You can request a quote for Dibutyl 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 Dibutyl pyridine-2,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dibutyl pyridine-2,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.