Methyl Quinoxaline-2-carboxylate - CAS 1865-11-8
Catalog: |
BB014331 |
Product Name: |
Methyl Quinoxaline-2-carboxylate |
CAS: |
1865-11-8 |
Synonyms: |
2-quinoxalinecarboxylic acid methyl ester; methyl quinoxaline-2-carboxylate |
IUPAC Name: | methyl quinoxaline-2-carboxylate |
Description: | Methyl Quinoxaline-2-carboxylate (CAS# 1865-11-8) is also used in the design of guanine-guanine selective DNA cleaving agents. |
Molecular Weight: | 188.18 |
Molecular Formula: | C10H8N2O2 |
Canonical SMILES: | COC(=O)C1=NC2=CC=CC=C2N=C1 |
InChI: | InChI=1S/C10H8N2O2/c1-14-10(13)9-6-11-7-4-2-3-5-8(7)12-9/h2-6H,1H3 |
InChI Key: | KDPBLDOVCGAWNQ-UHFFFAOYSA-N |
MDL: | MFCD02167640 |
LogP: | 1.41640 |
Publication Number | Title | Priority Date |
CN-112048734-A | Regioselective electrochemical synthesis method of nitrogen-containing aromatic heterocyclic carboxylic acid | 20200911 |
WO-2018116072-A1 | Heterocyclic compounds | 20161220 |
WO-2018064119-A1 | Calpain modulators and therapeutic uses thereof | 20160928 |
US-10934261-B2 | Calpain modulators and therapeutic uses thereof | 20160928 |
CN-107383024-A | The class compound of fused tricyclic containing imidazoles and its application | 20160912 |
PMID | Publication Date | Title | Journal |
12459027 | 20021205 | Synthesis and antimycobacterial activity of pyrazine and quinoxaline derivatives | Journal of medicinal chemistry |
Complexity: | 220 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.058577502 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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