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5-(Phenylsulfinyl)-1H-benzimidazol-2-amine

HCID 134259
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Basic information

CAS
69489-26-5
Standard SMILES
Nc1nc2ccc(S(=O)c3ccccc3)cc2[nH]1
InChIKey
IWVYUWQPDMROLN-UHFFFAOYSA-N
Molecular formula
C13H11N3OS
Average molar mass
257.31 g/mol
Monoisotopic mass
257.06228316

Names & identifiers

Preferred name
5-(Phenylsulfinyl)-1H-benzimidazol-2-amine
IUPAC
6-(benzenesulfinyl)-1H-benzimidazol-2-amine
English name
1H-Benzimidazol-2-amine,6-(phenylsulfinyl)-
Molecular formula
C13H11N3OS
Molecular weight
257.31094

Names & synonyms

69489-26-55-(Phenylsulfinyl)-1H-benzimidazol-2-amineOxfendazole EP Impurity C6-(benzenesulfinyl)-1H-benzimidazol-2-amine5-(PHENYLSULFINYL)-1H-BENZO[D]IMIDAZOL-2-AMINEZR38Z38HB3UNII-ZR38Z38HB31H-Benzimidazol-2-amine, 5-(phenylsulfinyl)-Oxfendazole Impurity C186-(Phenylsulfinyl)-1H-benzo[d]imidazol-2-amineDTXSID309894351H-BENZIMIDAZOL-2-AMINE, 6-(PHENYLSULFINYL)-
Show more names
1H-Benzimidazol-2-amine,6-(phenylsulfinyl)-Oxfendazole Impurity 3(Oxfendazole EP Impurity C)
Q272958535-(Benzenesulfinyl)-1,3-dihydro-2H-benzimidazol-2-imine5-(Benzenesulfinyl)-1,3-dihydro-2H-1,3-benzimidazol-2-imineOXFENDAZOLE FOR VETERINARY USE IMPURITY C [EP IMPURITY]6-(Phenylsulfinyl)-1H-benzimidazol-2-amine; 1H-Benzimidazol-2-amine, 5-(phenylsulfinyl)- (9CI)

Database identifiers

CAS
69489-26-5
PubChem CID
134259
DTXSID
DTXSID30989435
UNII
ZR38Z38HB3
Nikkaji
J515.958J

Properties

Computed structural properties

XLogP
2
Topological polar surface area
91 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
319

Physicochemical properties

FDA UNII
38 Z38HB3 · ZR38Z38HB3

Chemistry & industry

Applications

UsesFenbendazole-Amine Sulfoxide is a highly effective inhibitor of the helminth-specific enzyme, fumarate reductas in Ascaris suum. Also, it inhibits the polymerization of tubulin into microtubules in vitro.

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Compound notes

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