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Substance Name: 1-Acridinol, 1,2,3,4-tetrahydro-9-(((4-(trifluoromethyl)phenyl)methyl)amino)-
RN: 104628-37-7
InChIKey: OWMWWMZMOLIDRD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H19-F3-N2-O

Molecular Weight

  • 372.3881
 
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Names and Synonyms

Synonym

  • 9-(((4-(Trifluoromethyl)phenyl)methyl)amino)-1,2,3,4-tetrahydro-1-acridinol

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 104628-37-7

System Generated Number

  • 0104628377

Structure Descriptors

InChI

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

InChIKey

OWMWWMZMOLIDRD-UHFFFAOYSA-N

Smiles

C1[C@@H](c2c(c3ccccc3nc2CC1)NCc1ccc(cc1)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.