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Substance Name: Piperazine, 1-((6-methoxy-3-phenyl-2-benzofuranyl)methyl)-4-phenyl-, dihydrochloride, hydrate
RN: 102517-05-5
InChIKey: NLNUKMFQMBBSHJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H26-N2-O2.2Cl-H.H2-O

Molecular Weight

  • 489.44
 
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Names and Synonyms

Synonym

  • 2-(N-Phenylpiperazinomethyl)-6-methoxy-3-phenylbenzofuran dihydrochloride hydrate

Systematic Name

  • Piperazine, 1-((6-methoxy-3-phenyl-2-benzofuranyl)methyl)-4-phenyl-, dihydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 102517-05-5

System Generated Number

  • 0102517055

Molecular Formulas

Molecular Formula

  • C26-H26-N2-O2.2Cl-H.H2-O

Molecular Formula Fragments

  • C26-H26-N2-O2
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C26H26N2O2.2ClH.H2O/c1-29-22-12-13-23-24(18-22)30-25(26(23)20-8-4-2-5-9-20)19-27-14-16-28(17-15-27)21-10-6-3-7-11-21;;;/h2-13,18H,14-17,19H2,1H3;2*1H;1H2

InChIKey

NLNUKMFQMBBSHJ-UHFFFAOYSA-N

Smiles

o1c2c(ccc(c2)OC)c(c2ccccc2)c1CN1CCN(CC1)c1ccccc1.Cl.Cl.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Pharmaceutical Chemistry Journal Vol. 14, Pg. 169, 1980.