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Substance Name: Piperazine, 1-(1,3-benzodioxol-5-ylmethyl)-2,2,6-trimethyl-4-phenyl-, (S)-
RN: 62733-60-2
InChIKey: MEJPRKQWHLKYJP-INIZCTEOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N2-O2

Molecular Weight

  • 338.4484
 
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Names and Synonyms

Synonyms

  • (S)-1-(1,3-Benzodioxol-5-ylmethyl)-2,2,6-trimethyl-4-phenylpiperazine
  • 5-23-03-00342 (Beilstein Handbook Reference)
  • BRN 0555452

Systematic Name

  • Piperazine, 1-(1,3-benzodioxol-5-ylmethyl)-2,2,6-trimethyl-4-phenyl-, (S)-

Registry Numbers

CAS Registry Number

  • 62733-60-2

System Generated Number

  • 0062733602

Structure Descriptors

InChI

1S/C21H26N2O2/c1-16-12-22(18-7-5-4-6-8-18)14-21(2,3)23(16)13-17-9-10-19-20(11-17)25-15-24-19/h4-11,16H,12-15H2,1-3H3/t16-/m0/s1

InChIKey

MEJPRKQWHLKYJP-INIZCTEOSA-N

Smiles

C[C@H]1CN(CC(N1Cc2ccc3c(c2)OCO3)(C)C)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 395, 1976.