Dimethyl cathate
TL;DR: Dimethyl cathate (CAS 6651-16-7) is a chemical compound with molecular formula C18H19NO7 and molecular weight 361.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(2,6-dimethoxy-4-methoxycarbonylphenoxy)methyl]pyridine-3-carboxylate
Also Known As: Dimethyl cathate, 3-Pyridinecarboxylic acid, 4-((2,6-dimethoxy-4-(methoxycarbonyl)phenoxy)methyl)-, methyl ester, 4-(3',5'-Dimethoxy-4'-carboxyphenoxymethyl)nicotinic acid dimethyl ester, methyl 4-[(2,6-dimethoxy-4-methoxycarbonylphenoxy)methyl]pyridine-3-carboxylate, methyl 4-{[2,6-dimethoxy-4-(methoxycarbonyl)phenoxy]methyl}pyridine-3-carboxylate
| Molecular Formula | C18H19NO7 |
|---|---|
| Molecular Weight | 361.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 93.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 361.11615 |
| Heavy Atoms | 26 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 6651-16-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OCC2=C(C=NC=C2)C(=O)OC)OC)C(=O)OC |
| InChIKey | AJZQTXFCEBGQOO-UHFFFAOYSA-N |
Product Overview
Dimethyl cathate (CAS 6651-16-7), with molecular formula C18H19NO7 and molecular weight 361.12 g/mol. IUPAC: methyl 4-[(2,6-dimethoxy-4-methoxycarbonylphenoxy)methyl]pyridine-3-carboxylate.
Chemical Property Profile of Dimethyl cathate
Property Insights of Dimethyl cathate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl cathate. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl cathate. Following Lipinski's Rule of Five, Dimethyl cathate has 0 hydrogen bond donor(s) and 8 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 cathate?
The CAS number of Dimethyl cathate is 6651-16-7.
What is the molecular formula of Dimethyl cathate?
The molecular formula of Dimethyl cathate is C18H19NO7.
What is the molecular weight of Dimethyl cathate?
The molecular weight of Dimethyl cathate is 361.12 g/mol.
Where can I buy Dimethyl cathate?
You can request a quote for Dimethyl cathate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl cathate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl cathate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.