Clemizole hydrochloride

C19H21Cl2N3CAS 1163-36-6362.30 g/mol

HClClNNN
Aryl halideTertiary amine

Properties

Molecular formula
C19H21Cl2N3
Molar mass
362.30 g/mol
Exact mass
361.1113 Da
Melting point
239–241 °C
logP
4.76Crippen estimate
Polar surface area
21.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
4

Identifiers

CAS number
1163-36-6
SMILES
Cl.Clc1ccc(Cn2c(CN3CCCC3)nc3ccccc32)cc1
InChIKey
DNFMJYXRIMLMBZ-UHFFFAOYSA-N
InChI
InChI=1S/C19H20ClN3.ClH/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22;/h1-2,5-10H,3-4,11-14H2;1H

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Names and synonyms

12 names
  • 1H-Benzimidazole, 1-[(4-chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-, hydrochloride (1:1)
  • Benzimidazole, 1-(p-chlorobenzyl)-2-(1-pyrrolidinylmethyl)-, monohydrochloride
  • 1H-Benzimidazole, 1-[(4-chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-, monohydrochloride
  • 1-p-Chlorobenzyl-2-(1-pyrrolidinylmethyl)benzimidazole hydrochloride
  • 1-(4-Chlorobenzyl)-2-(pyrrolidinylmethyl)-1,3-benzimidazole hydrochloride
  • 1-p-Chlorobenzyl-2-pyrrolidylmethyl benzimidazole hydrochloride
  • Reactrol
  • Allercur
  • Klemidox
  • Histacuran
  • AL 20
  • 1-(4-Chlorobenzyl)-2-(pyrrolidin-1-ylmethyl)-1H-benzo[d]imidazole hydrochloride

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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