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Substance Name: Biguanide, 1-(p-chlorophenyl)-5-(2-(4-(((p-chlorophenyl)amidino)amidino)-1-piperazinyl)ethyl)-, dihydrochloride, hydrate
RN: 19803-78-2
InChIKey: DATHNFHEFSYTRU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-Cl2-N11.2Cl-H.H2-O

Molecular Weight

  • 591.376
 
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Names and Synonyms

  • Biguanide, 1-(p-chlorophenyl)-5-(2-(4-(((p-chlorophenyl)amidino)amidino)-1-piperazinyl)ethyl)-, dihydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 19803-78-2

System Generated Number

  • 0019803782

Molecular Formulas

Molecular Formula

  • C22-H29-Cl2-N11.2Cl-H.H2-O

Molecular Formula Fragments

  • C22-H29-Cl2-N11
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C22H29Cl2N11.2ClH/c23-15-1-5-17(6-2-15)30-20(26)32-19(25)29-9-10-34-11-13-35(14-12-34)22(28)33-21(27)31-18-7-3-16(24)4-8-18;;/h1-8H,9-14H2,(H4,27,28,31,33)(H5,25,26,29,30,32);2*1H

InChIKey

DATHNFHEFSYTRU-UHFFFAOYSA-N

Smiles

Cl.Cl.C(N1CCN(CCNC(NC(Nc2ccc(cc2)Cl)=N)=N)CC1)(NC(Nc1ccc(cc1)Cl)=N)=N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 942, 1968.