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Substance Name: Acetamide, 2-(4-chlorophenoxy)-N-(3-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)propyl)-, dihydrochloride
RN: 87576-01-0
InChIKey: ABZOUFGQKZQAPC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H26-Cl-N3-O2.2Cl-H

Molecular Weight

  • 412.7862
 
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Names and Synonyms

Synonym

  • 2-(4-Chlorophenoxy)-N-(3-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)propyl)acetamide 2HCl

Systematic Name

  • Acetamide, 2-(4-chlorophenoxy)-N-(3-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)propyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 87576-01-0

System Generated Number

  • 0087576010

Molecular Formulas

Molecular Formula

  • C17-H26-Cl-N3-O2.2Cl-H

Molecular Formula Fragments

  • C17-H26-Cl-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H26ClN3O2.2ClH/c1-20-9-3-11-21(13-12-20)10-2-8-19-17(22)14-23-16-6-4-15(18)5-7-16;;/h4-7H,2-3,8-14H2,1H3,(H,19,22);2*1H

InChIKey

ABZOUFGQKZQAPC-UHFFFAOYSA-N

Smiles

CN1CCCN(CC1)CCCNC(=O)COc2ccc(cc2)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 730mg/kg (730mg/kg)   Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 39, Pg. 361, 1982.