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Substance Name: 5H-Pyrido(4,3-b)indole, 1,2,3,4-tetrahydro-5-(2-(dimethylamino)ethyl)-1,1,3,3-tetramethyl-8-trifluoromethyl-, dihydrochloride
RN: 40431-51-4
InChIKey: XFNFHCKEZLKJMS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H28-F3-N3.2Cl-H

Molecular Weight

  • 440.378
 
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Names and Synonyms

  • 5H-Pyrido(4,3-b)indole, 1,2,3,4-tetrahydro-5-(2-(dimethylamino)ethyl)-1,1,3,3-tetramethyl-8-trifluoromethyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 40431-51-4

System Generated Number

  • 0040431514

Molecular Formulas

Molecular Formula

  • C20-H28-F3-N3.2Cl-H

Molecular Formula Fragments

  • C20-H28-F3-N3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H28F3N3.2ClH/c1-18(2)12-16-17(19(3,4)24-18)14-11-13(20(21,22)23)7-8-15(14)26(16)10-9-25(5)6;;/h7-8,11,24H,9-10,12H2,1-6H3;2*1H

InChIKey

XFNFHCKEZLKJMS-UHFFFAOYSA-N

Smiles

CC1(Cc2c(c3cc(ccc3n2CCN(C)C)C(F)(F)F)C(N1)(C)C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 84mg/kg (84mg/kg)   Pharmaceutical Chemistry Journal Vol. 6, Pg. 512, 1972.