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92919-36-3 | [1(2H),2'-Biquinoline]-2-thione
CAS No: 92919-36-3 Catalog No: AG0067KF MDL No:
Product Description
Catalog Number:
AG0067KF
Chemical Name:
[1(2H),2'-Biquinoline]-2-thione
CAS Number:
92919-36-3
Molecular Formula:
C18H12N2S
Molecular Weight:
288.3663
IUPAC Name:
1-quinolin-2-ylquinoline-2-thione
InChI:
InChI=1S/C18H12N2S/c21-18-12-10-14-6-2-4-8-16(14)20(18)17-11-9-13-5-1-3-7-15(13)19-17/h1-12H
InChI Key:
DRJJBLONQAJBSC-UHFFFAOYSA-N
SMILES:
S=c1ccc2c(n1c1ccc3c(n1)cccc3)cccc2
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.072g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.368g/mol
Monoisotopic Mass:
288.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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