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1199773-39-1 | Thiazolo[4,5-b]pyridine-2(3H)-thione, 6-(trifluoromethyl)-
CAS No: 1199773-39-1 Catalog No: AG000PYH MDL No:MFCD13195715
Product Description
Catalog Number:
AG000PYH
Chemical Name:
Thiazolo[4,5-b]pyridine-2(3H)-thione, 6-(trifluoromethyl)-
CAS Number:
1199773-39-1
Molecular Formula:
C7H3F3N2S2
Molecular Weight:
236.2373
MDL Number:
MFCD13195715
IUPAC Name:
6-(trifluoromethyl)-3H-[1,3]thiazolo[4,5-b]pyridine-2-thione
InChI:
InChI=1S/C7H3F3N2S2/c8-7(9,10)3-1-4-5(11-2-3)12-6(13)14-4/h1-2H,(H,11,12,13)
InChI Key:
FGPULQJCUIQMEF-UHFFFAOYSA-N
SMILES:
FC(c1cnc2c(c1)sc(=S)[nH]2)(F)F
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.969g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.23g/mol
Monoisotopic Mass:
235.969g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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