Epsiprantel

CAT: 0804-HY-U00045-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-U00045-01Size:1 mg

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Description

Epsiprantel (BRL-38705) is a compound with anti-Echinococcus activity that can cause the death of protoscolex, larvae and adults in vitro, and is more effective against mature worms than larvae in vivo, with no side effects.

CAS Number

98123-83-2

Product Name Alternative

BRL-38705

UNSPSC

12352005

Hazard Statement

H302-H315-H319-H335-H412

Target

Parasite

Type

Reference compound

Related Pathways

Anti-infection

Applications

COVID-19-immunoregulation

Field of Research

Others

Assay Protocol

https://www.medchemexpress.com/epsiprantel.html

Smiles

O=C1CN(C(C2CCCCC2)=O)CC3C4=CC=CC=C4CCCN31

Molecular Formula

C20H26N2O2

Molecular Weight

326.43

Precautions

P261-P264-P270-P271-P273-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

References & Citations

[1]In vitro and in vivo efficacy of epsiprantel against Echinococcus granulosus

Shipping Conditions

Room temperature

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Chemical Information

Epsiprantel

RN given refers to cpd without isomeric designation

CAS Number	98123-83-2
PubChem CID	72026
IUPAC Name	2-(cyclohexanecarbonyl)-1,3,6,7,8,12b-hexahydropyrazino[2,1-a][2]benzazepin-4-one
Molecular Formula	C20H26N2O2
Molecular Weight	326.4
XLogP	3
Topological Polar Surface Area	40.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	24
Formal Charge	0
Complexity	486

SMILES

C1CCC(CC1)C(=O)N2CC3C4=CC=CC=C4CCCN3C(=O)C2

InChI

InChI=1S/C20H26N2O2/c23-19-14-21(20(24)16-8-2-1-3-9-16)13-18-17-11-5-4-7-15(17)10-6-12-22(18)19/h4-5,7,11,16,18H,1-3,6,8-10,12-14H2

InChIKey

LGUDKOQUWIHXOV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 98123-83-2

CID: 72026

Formula: C20H26N2O2

MW: 326.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	326.4
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	326.199428076
Monoisotopic Mass	326.199428076
Topological Polar Surface Area	40.6 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	486
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

Alternative Products

Catalog	Name
GTR19197675-01	Epsiprantel

Epsiprantel

Chemical Information

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