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Substance Name: Benzamide, 4-amino-2,6-dimethyl-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-, trihydrochloride, monohydrate
RN: 104373-49-1
InChIKey: MGLCWNFJHOJOEK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N5-O.3Cl-H.H2-O

Molecular Weight

  • 462.85
 
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Names and Synonyms

Synonym

  • 4-Amino-2,6-dimethyl-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)benzamide trihydrochloride H2O

Systematic Name

  • Benzamide, 4-amino-2,6-dimethyl-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-, trihydrochloride, monohydrate

Registry Numbers

CAS Registry Number

  • 104373-49-1

System Generated Number

  • 0104373491

Molecular Formulas

Molecular Formula

  • C20-H27-N5-O.3Cl-H.H2-O

Molecular Formula Fragments

  • C20-H27-N5-O
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C20H27N5O.3ClH/c1-15-13-17(21)14-16(2)19(15)20(26)23-7-8-24-9-11-25(12-10-24)18-5-3-4-6-22-18;;;/h3-6,13-14H,7-12,21H2,1-2H3,(H,23,26);3*1H

InChIKey

MGLCWNFJHOJOEK-UHFFFAOYSA-N

Smiles

N1(c2ncccc2)CCN(CC1)CCNC(c1c(cc(cc1C)N)C)=O.Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 264mg/kg (264mg/kg)   Journal of Medicinal Chemistry. Vol. 30, Pg. 13, 1987.