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Substance Name: 1-Acridinol, 1,2,3,4-tetrahydro-9-(((2-(trifluoromethyl)phenyl)methyl)amino)-
RN: 104628-34-4
InChIKey: IJPJFSRSZPHFNX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H19-F3-N2-O

Molecular Weight

  • 372.3881
 
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Names and Synonyms

Synonym

  • 1,2,3,4-Tetrahydro-9-(((2-(trifluoromethyl)phenyl)methyl)amino)-1-acridinol

Systematic Name

  • 1-Acridinol, 1,2,3,4-tetrahydro-9-(((2-(trifluoromethyl)phenyl)methyl)amino)-

Registry Numbers

CAS Registry Number

  • 104628-34-4

System Generated Number

  • 0104628344

Structure Descriptors

InChI

1S/C21H19F3N2O/c22-21(23,24)15-8-3-1-6-13(15)12-25-20-14-7-2-4-9-16(14)26-17-10-5-11-18(27)19(17)20/h1-4,6-9,18,27H,5,10-12H2,(H,25,26)

InChIKey

IJPJFSRSZPHFNX-UHFFFAOYSA-N

Smiles

C1[C@@H](c2c(c3ccccc3nc2CC1)NCc1c(cccc1)C(F)(F)F)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 80mg/kg (80mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 1805, 1989.