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832081-83-1 | Quinoxaline, 2-(1-piperidinyl)-3-(2-thienyl)-
CAS No: 832081-83-1 Catalog No: AG004ZZ4 MDL No:
Product Description
Catalog Number:
AG004ZZ4
Chemical Name:
Quinoxaline, 2-(1-piperidinyl)-3-(2-thienyl)-
CAS Number:
832081-83-1
Molecular Formula:
C17H17N3S
Molecular Weight:
295.4020
IUPAC Name:
2-piperidin-1-yl-3-thiophen-2-ylquinoxaline
InChI:
InChI=1S/C17H17N3S/c1-4-10-20(11-5-1)17-16(15-9-6-12-21-15)18-13-7-2-3-8-14(13)19-17/h2-3,6-9,12H,1,4-5,10-11H2
InChI Key:
NDQSCEGDLKYDFS-UHFFFAOYSA-N
SMILES:
C1CCN(CC1)c1nc2ccccc2nc1c1cccs1
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.114g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.404g/mol
Monoisotopic Mass:
295.114g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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