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155584-74-0 | Quinoxaline, 2-chloro-3-(4-methyl-1-piperazinyl)-
CAS No: 155584-74-0 Catalog No: AG001O0N MDL No:MFCD01127814
Product Description
Catalog Number:
AG001O0N
Chemical Name:
Quinoxaline, 2-chloro-3-(4-methyl-1-piperazinyl)-
CAS Number:
155584-74-0
Molecular Formula:
C13H15ClN4
Molecular Weight:
262.7380
MDL Number:
MFCD01127814
IUPAC Name:
2-chloro-3-(4-methylpiperazin-1-yl)quinoxaline
InChI:
InChI=1S/C13H15ClN4/c1-17-6-8-18(9-7-17)13-12(14)15-10-4-2-3-5-11(10)16-13/h2-5H,6-9H2,1H3
InChI Key:
FFXVTQDGTKEXHF-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1nc2ccccc2nc1Cl
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.741g/mol
Monoisotopic Mass:
262.099g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| VUF10166, a novel compound with differing activities at 5-HT₃A and 5-HT₃AB receptors. | The Journal of pharmacology and experimental therapeutics 20120501 |
| Fragment based design of new H4 receptor-ligands with anti-inflammatory properties in vivo. | Journal of medicinal chemistry 20080424 |
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