2-[(4-chloro-3-methylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole


Chemical Name: 2-[(4-chloro-3-methylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole
CAS Number: 168167-42-8
Product Number: AG001XVN(AGN-PC-0071FT)
Synonyms:
MDL No:
Molecular Formula: C14H12ClN3OS
Molecular Weight: 305.7826

Identification/Properties


Computed Properties
Molecular Weight:
305.78g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
305.039g/mol
Monoisotopic Mass:
305.039g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
370
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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