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160006-48-4 | 6-Quinolinecarbonitrile, 2-(1-piperazinyl)-
CAS No: 160006-48-4 Catalog No: AG001RLO MDL No:
Product Description
Catalog Number:
AG001RLO
Chemical Name:
6-Quinolinecarbonitrile, 2-(1-piperazinyl)-
CAS Number:
160006-48-4
Molecular Formula:
C14H14N4
Molecular Weight:
238.2878
IUPAC Name:
2-piperazin-1-ylquinoline-6-carbonitrile
InChI:
InChI=1S/C14H14N4/c15-10-11-1-3-13-12(9-11)2-4-14(17-13)18-7-5-16-6-8-18/h1-4,9,16H,5-8H2
InChI Key:
NKWFAUALMFRAPD-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)ccc(n2)N1CCNCC1
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.122g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.294g/mol
Monoisotopic Mass:
238.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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