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Substance Name: Poli 94
RN: 21484-40-2
InChIKey: GWTGTXWJLCHEKF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-N3-O.Cl-H

Molecular Weight

  • 387.952
 
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Names and Synonyms

Results Name

  • Poli 94

Synonyms

  • 3-(Hexahydro-1H-azepin-1-yl)-1-(4,5,6,7-tetrahydro-1-phenyl-1H-indazol-3-yl)-1-propanone HCl
  • Poli 94

Systematic Name

  • 1-Propanone, 3-(hexahydro-1H-azepin-1-yl)-1-(4,5,6,7-tetrahydro-1-phenyl-1H-indazol-3-yl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 21484-40-2

System Generated Number

  • 0021484402

Molecular Formulas

Molecular Formula

  • C22-H29-N3-O.Cl-H

Molecular Formula Fragments

  • C22-H29-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H29N3O.ClH/c26-21(14-17-24-15-8-1-2-9-16-24)22-19-12-6-7-13-20(19)25(23-22)18-10-4-3-5-11-18;/h3-5,10-11H,1-2,6-9,12-17H2;1H

InChIKey

GWTGTXWJLCHEKF-UHFFFAOYSA-N

Smiles

C(CCN1CCCCCC1)(=O)c1nn(c2CCCCc12)c1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 250mg/kg (250mg/kg)   Bollettino Chimico Farmaceutico. Vol. 109, Pg. 679, 1970.