Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate
TL;DR: Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate (CAS 77479-01-7) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[5-(3-methoxy-3-oxopropyl)pyrazin-2-yl]propanoate
Also Known As: Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate, Methyl-3-[5-(2-methoxycarbonylethyl)pyrazin-2-yl]propionate, Methyl aminolevulinate EP Impurity C, 2,5-Pyrazinedipropanoic Acid Dimethyl Ester, Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropionate
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 77479-01-7 |
|---|---|
| SMILES | COC(=O)CCC1=CN=C(C=N1)CCC(=O)OC |
| InChIKey | CAVDNRICPLKYEH-UHFFFAOYSA-N |
Product Overview
Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate (CAS 77479-01-7), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: methyl 3-[5-(3-methoxy-3-oxopropyl)pyrazin-2-yl]propanoate.
Chemical Property Profile of Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate
Property Insights of Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate. Following Lipinski's Rule of Five, Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate has 0 hydrogen bond donor(s) and 6 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 3,3'-(pyrazine-2,5-diyl)dipropanoate?
The CAS number of Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate is 77479-01-7.
What is the molecular formula of Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate?
The molecular formula of Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate is C12H16N2O4.
What is the molecular weight of Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate?
The molecular weight of Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate is 252.11 g/mol.
Where can I buy Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate?
You can request a quote for Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3,3'-(pyrazine-2,5-diyl)dipropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.