1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate
TL;DR: 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate (CAS 786728-65-2) is a chemical compound with molecular formula C18H16ClNO6 and molecular weight 377.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-(6-chloropyridine-3-carbonyl)oxybenzene-1,3-dicarboxylate
Also Known As: diethyl 5-(6-chloropyridine-3-carbonyl)oxybenzene-1,3-dicarboxylate, 1,3-diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate
| Molecular Formula | C18H16ClNO6 |
|---|---|
| Molecular Weight | 377.07 g/mol |
| LogP | 3.3076 |
| Topological Polar Surface Area | 91.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.06662 |
| Heavy Atoms | 26 |
| Complexity | 782.6811 |
Chemical Identifiers
| CAS Number | 786728-65-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC(=C1)OC(=O)C2=CN=C(C=C2)Cl)C(=O)OCC |
Product Overview
1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate (CAS 786728-65-2), with molecular formula C18H16ClNO6 and molecular weight 377.07 g/mol. IUPAC: diethyl 5-(6-chloropyridine-3-carbonyl)oxybenzene-1,3-dicarboxylate.
Chemical Property Profile of 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate
Property Insights of 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate
The XLogP value of 3.3076 indicates that 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate. Following Lipinski's Rule of Five, 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-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 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate?
The CAS number of 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate is 786728-65-2.
What is the molecular formula of 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate?
The molecular formula of 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate is C18H16ClNO6.
What is the molecular weight of 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate?
The molecular weight of 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate is 377.07 g/mol.
Where can I buy 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate?
You can request a quote for 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diethyl 5-(6-chloropyridine-3-carbonyloxy)benzene-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.