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Substance Name: 1-Butanone, 1-(4-(3-chlorophenyl)-1-(3-(4-methyl-1-piperazinyl)propyl)-4-piperidinyl)-, trihydrochloride
RN: 62270-82-0
InChIKey: MBEZLFZGNHSRRB-UHFFFAOYSA-N

Molecular Formula

  • C23-H36-Cl-N3-O.3Cl-H

Molecular Weight

  • 515.393
 
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Names and Synonyms

Synonym

  • 1-(4-(3-Chlorophenyl)-1-(3-(4-methyl-1-piperazinyl)propyl)-4-piperidinyl)-1-butanone 3HCl

Systematic Name

  • 1-Butanone, 1-(4-(3-chlorophenyl)-1-(3-(4-methyl-1-piperazinyl)propyl)-4-piperidinyl)-, trihydrochloride

Registry Numbers

CAS Registry Number

  • 62270-82-0

System Generated Number

  • 0062270820

Molecular Formulas

Molecular Formula

  • C23-H36-Cl-N3-O.3Cl-H

Molecular Formula Fragments

  • C23-H36-Cl-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H36ClN3O.3ClH/c1-3-6-22(28)23(20-7-4-8-21(24)19-20)9-13-26(14-10-23)11-5-12-27-17-15-25(2)16-18-27;;;/h4,7-8,19H,3,5-6,9-18H2,1-2H3;3*1H

InChIKey

MBEZLFZGNHSRRB-UHFFFAOYSA-N

Smiles

C1(c2cc(Cl)ccc2)(CCN(CCCN2CCN(CC2)C)CC1)C(=O)CCC.Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 104mg/kg (104mg/kg)   Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 33, Pg. 169, 1976.