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Substance Name: 1-Piperazineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-4-methyl-, dihydrochloride, (4-alpha,4a-beta,9b-beta)-
RN: 58322-94-4
InChIKey: GGWWROZIHCROQN-DNVJILQESA-N

Molecular Formula

  • C21-H29-N3-O3.2Cl-H

Molecular Weight

  • 444.3999
 
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Names and Synonyms

  • 1-Piperazineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-4-methyl-, dihydrochloride, (4-alpha,4a-beta,9b-beta)-

Registry Numbers

CAS Registry Number

  • 58322-94-4

System Generated Number

  • 0058322944

Molecular Formulas

Molecular Formula

  • C21-H29-N3-O3.2Cl-H

Molecular Formula Fragments

  • C21-H29-N3-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H29N3O3.2ClH/c1-14-4-5-17-15(12-14)21(2)7-6-16(25)19(20(21)27-17)22-18(26)13-24-10-8-23(3)9-11-24;;/h4-5,12,19-20H,6-11,13H2,1-3H3,(H,22,26);2*1H/t19-,20-,21-;;/m1../s1

InChIKey

GGWWROZIHCROQN-DNVJILQESA-N

Smiles

Cc1ccc2c(c1)[C@]3(CCC(=O)[C@H]([C@H]3O2)NC(=O)CN4CCN(CC4)C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral > 800mg/kg (800mg/kg)   United States Patent Document. Vol. #4010268,