1H-Benzimidazole, 2-[[(4-methoxy-3-methyl-2-pyridinyl)methyl]sulfinyl]-


Chemical Name: 1H-Benzimidazole, 2-[[(4-methoxy-3-methyl-2-pyridinyl)methyl]sulfinyl]-
CAS Number: 102804-77-3
Product Number: AG008WYT(AGN-PC-00BK7P)
Synonyms:
MDL No:
Molecular Formula: C15H15N3O2S
Molecular Weight: 301.3635

Identification/Properties


Computed Properties
Molecular Weight:
301.364g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
301.088g/mol
Monoisotopic Mass:
301.088g/mol
Topological Polar Surface Area:
87.1A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
382
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

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NMR Spectrum


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