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Home Other Building Blocks 2(1H)-Quinolinethione

2(1H)-Quinolinethione

CAS No.:
2637-37-8
Catalog Number:
AG002SWR
Molecular Formula:
C9H7NS
Molecular Weight:
161.2236
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Product Description
Catalog Number:
AG002SWR
Chemical Name:
2(1H)-Quinolinethione
CAS Number:
2637-37-8
Molecular Formula:
C9H7NS
Molecular Weight:
161.2236
MDL Number:
MFCD00006751
IUPAC Name:
1H-quinoline-2-thione
InChI:
InChI=1S/C9H7NS/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11)
InChI Key:
KXZSVYHFYHTNBI-UHFFFAOYSA-N
SMILES:
S=c1ccc2c([nH]1)cccc2
EC Number:
220-132-4
UNII:
XW9BW0P3YZ
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.03g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
161.222g/mol
Monoisotopic Mass:
161.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Unique metabolic pathway of [(14)C]lenvatinib after oral administration to male cynomolgus monkey. Drug metabolism and disposition: the biological fate of chemicals 20120401
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Decacarbonyl-1κC,2κC,3κC-μ-hydrido-1:2κH:H-(μ-quinoline-2-thiol-ato-1:2κS:S)diosmium(I)osmium(0)(3 Os-Os). Acta crystallographica. Section E, Structure reports online 20080501
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Quinoline-2(1H)-thione, a structure with Z' = 8. Acta crystallographica. Section C, Crystal structure communications 20041201
Properties