2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate
TL;DR: 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate (CAS 312947-85-6) is a chemical compound with molecular formula C15H14N2O3 and molecular weight 270.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dimethylphenyl)-2-oxoethyl] pyrazine-2-carboxylate
Also Known As: TimTec1_007654, 2-(3,4-dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate, BAS 06997481, IDI1_033308, UPCMLD0ENAT5607708:001
| Molecular Formula | C15H14N2O3 |
|---|---|
| Molecular Weight | 270.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 69.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.10043 |
| Heavy Atoms | 20 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 312947-85-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)COC(=O)C2=NC=CN=C2)C |
| InChIKey | HIKOIVKWRDMEQQ-UHFFFAOYSA-N |
Product Overview
2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate (CAS 312947-85-6), with molecular formula C15H14N2O3 and molecular weight 270.10 g/mol. IUPAC: [2-(3,4-dimethylphenyl)-2-oxoethyl] pyrazine-2-carboxylate.
Chemical Property Profile of 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate
Property Insights of 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate. The TPSA of 69.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate. Following Lipinski's Rule of Five, 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate 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 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate?
The CAS number of 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate is 312947-85-6.
What is the molecular formula of 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate?
The molecular formula of 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate is C15H14N2O3.
What is the molecular weight of 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate?
The molecular weight of 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate is 270.10 g/mol.
Where can I buy 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate?
You can request a quote for 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethylphenyl)-2-oxoethyl pyrazine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.