5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(2-methylsulfonylphenyl)methoxy]thiophene-2-carbonitrile


Chemical Name: 5-(5,6-dimethoxybenzimidazol-1-yl)-3-[(2-methylsulfonylphenyl)methoxy]thiophene-2-carbonitrile
CAS Number: 862812-98-4
Product Number: AG004JGY(AGN-PC-00CY2H)
Synonyms:
MDL No: MFCD10567700
Molecular Formula: C22H19N3O5S2
Molecular Weight: 469.5334

Identification/Properties


Computed Properties
Molecular Weight:
469.53g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
7
Exact Mass:
469.077g/mol
Monoisotopic Mass:
469.077g/mol
Topological Polar Surface Area:
140A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
797
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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