Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate
TL;DR: Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate (CAS 104883-73-0) is a chemical compound with molecular formula C15H13N3O4 and molecular weight 299.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-cyano-6-(3,4-dimethoxyphenyl)pyrazine-2-carboxylate
Also Known As: AQ-917/42754572, methyl 3-cyano-6-(3,4-dimethoxyphenyl)pyrazine-2-carboxylate, methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate
| Molecular Formula | C15H13N3O4 |
|---|---|
| Molecular Weight | 299.09 g/mol |
| LogP | 1.81908 |
| Topological Polar Surface Area | 94.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.0906 |
| Heavy Atoms | 22 |
| Complexity | 752.9382 |
Chemical Identifiers
| CAS Number | 104883-73-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CN=C(C(=N2)C(=O)OC)C#N)OC |
Product Overview
Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate (CAS 104883-73-0), with molecular formula C15H13N3O4 and molecular weight 299.09 g/mol. IUPAC: methyl 3-cyano-6-(3,4-dimethoxyphenyl)pyrazine-2-carboxylate.
Chemical Property Profile of Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate
Property Insights of Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate
The XLogP value of 1.81908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate. The TPSA of 94.33 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate. Following Lipinski's Rule of Five, Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate 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 Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate?
The CAS number of Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate is 104883-73-0.
What is the molecular formula of Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate?
The molecular formula of Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate is C15H13N3O4.
What is the molecular weight of Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate?
The molecular weight of Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate is 299.09 g/mol.
Where can I buy Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate?
You can request a quote for Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-cyano-6-(3,4-dimethoxyphenyl)-2-pyrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.