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Substance Name: Piperazine, 1-(3,6-dimethyl-2-pyrazinyl)-4-(3,3,3-triphenylpropyl)-, dihydrochloride, hemihydrate
RN: 63978-42-7
InChIKey: GOVCMYRPHYQXTB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H37-N5.2Cl-H.1/2H2-O

Molecular Weight

  • 1089.13
 
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Names and Synonyms

  • Piperazine, 1-(3,6-dimethyl-2-pyrazinyl)-4-(3,3,3-triphenylpropyl)-, dihydrochloride, hemihydrate

Registry Numbers

CAS Registry Number

  • 63978-42-7

System Generated Number

  • 0063978427

Molecular Formulas

Molecular Formula

  • C33-H37-N5.2Cl-H.1/2H2-O

Molecular Formula Fragments

  • C33-H37-N5
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/2C31H34N4.4ClH.H2O/c2*1-25-24-32-26(2)30(33-25)35-22-20-34(21-23-35)19-18-31(27-12-6-3-7-13-27,28-14-8-4-9-15-28)29-16-10-5-11-17-29;;;;;/h2*3-17,24H,18-23H2,1-2H3;4*1H;1H2

InChIKey

GOVCMYRPHYQXTB-UHFFFAOYSA-N

Smiles

c1(N2CCN(CC2)CCC(c2ccccc2)(c2ccccc2)c2ccccc2)nc(cnc1C)C.Cl.O.c1(N2CCN(CC2)CCC(c2ccccc2)(c2ccccc2)c2ccccc2)nc(cnc1C)C.Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 295, 1972.