1H-Benzimidazol-5-ol,2-[[[3-methyl-4-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]thio]-


Chemical Name: 1H-Benzimidazol-5-ol,2-[[[3-methyl-4-(2,2,2-trifluoroethoxy)-2-pyridinyl]methyl]thio]-
CAS Number: 131926-96-0
Product Number: AG009EKK(AGN-PC-0PJLU0)
Synonyms:
MDL No:
Molecular Formula: C16H14F3N3O2S
Molecular Weight: 369.3614696

Identification/Properties


Computed Properties
Molecular Weight:
369.362g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
5
Exact Mass:
369.076g/mol
Monoisotopic Mass:
369.076g/mol
Topological Polar Surface Area:
96.3A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
443
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


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