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Oxfendazole

CAT: 1299-RM-O240600-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-O240600-02Size:25 mg
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CAS Number
53716-50-0
Synonyms
Methyl (5- (phenylsulfinyl) -1H-benzo[d]imidazol-2-yl) carbamate
Molecular Formula
C15H13N3O3S
Molecular Weight
315.35
Target Alternative Name
Oxfendazole
Product Name Synonym
Methyl (5- (phenylsulfinyl) -1H-benzo[d]imidazol-2-yl) carbamate

Chemical Information

Oxfendazole

Oxfendazole is a member of the class of benzimidazoles that is fenbendazole in which the sulfur has been oxidised to the corresponding sulfoxide. It has a role as an antinematodal drug. It is a sulfoxide, a member of benzimidazoles and a carbamate ester. It is functionally related to a fenbendazole.

CAS Number53716-50-0
PubChem CID40854
IUPAC Namemethyl N-[6-(benzenesulfinyl)-1H-benzimidazol-2-yl]carbamate
Molecular FormulaC15H13N3O3S
Molecular Weight315.3
XLogP2.3
Topological Polar Surface Area103
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity428
SMILES
COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)C3=CC=CC=C3
InChI
InChI=1S/C15H13N3O3S/c1-21-15(19)18-14-16-12-8-7-11(9-13(12)17-14)22(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
InChIKey
BEZZFPOZAYTVHN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Oxfendazole
CAS: 53716-50-0
CID: 40854
Formula: C15H13N3O3S
MW: 315.3
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.3
XLogP32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass315.06776246
Monoisotopic Mass315.06776246
Topological Polar Surface Area103 Ų
Heavy Atom Count22
Formal Charge0
Complexity428
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
462880Oxfendazole
HY-B0291R-01Oxfendazole (Standard)
AR-O01641-01Oxfendazole-d3

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