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Parbendazole

CAT: 0926-PAA25587-02Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-PAA25587-02Size:0.5 g
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CAS Number
14255-87-9
MDL Number
MFCD18910864
Smiles
CCCCC1=CC2=C (C=C1) N=C (N2) NC (=O) OC
Molecular Formula
C13H17N3O2
Molecular Weight
247.29 g/mol
Controlled
No

Chemical Information

Parbendazole

Parbendazole is a member of the class of benzimidazoles that is 1H-benzimidazole substituted by (methoxycarbonyl)amino and butyl groups at positions 2 and 5, respectively. It is a potent inhibitor of microtubule assembly and also exhibits anthelminthic activity. It has a role as an anthelminthic drug, an antinematodal drug, an antineoplastic agent and a microtubule-destabilising agent. It is a member of benzimidazoles and a carbamate ester.

CAS Number14255-87-9
PubChem CID26596
IUPAC Namemethyl N-(6-butyl-1H-benzimidazol-2-yl)carbamate
Molecular FormulaC13H17N3O2
Molecular Weight247.29
XLogP3.4
Topological Polar Surface Area67
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count18
Formal Charge0
Complexity285
SMILES
CCCCC1=CC2=C(C=C1)N=C(N2)NC(=O)OC
InChI
InChI=1S/C13H17N3O2/c1-3-4-5-9-6-7-10-11(8-9)15-12(14-10)16-13(17)18-2/h6-8H,3-5H2,1-2H3,(H2,14,15,16,17)
InChIKey
YRWLZFXJFBZBEY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Parbendazole
CAS: 14255-87-9
CID: 26596
Formula: C13H17N3O2
MW: 247.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight247.29
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass247.132076794
Monoisotopic Mass247.132076794
Topological Polar Surface Area67 Ų
Heavy Atom Count18
Formal Charge0
Complexity285
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA2057-25Parbendazole
AR-P01193-01Parbendazole-d3
HY-115364R-01Parbendazole (Standard)
A18981-100Parbendazole 100mg
A18981-10Parbendazole 10mg
A18981-5Parbendazole 5mg

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