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Substance Name: 1-Acridinol, 1,2,3,4-tetrahydro-6-fluoro-9-(((2-(trifluoromethyl)phenyl)methyl)amino)-
RN: 104628-35-5
InChIKey: LSWZHJUDTDSZPN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H18-F4-N2-O

Molecular Weight

  • 390.3782
 
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Names and Synonyms

Synonym

  • 6-Fluoro-9-(((2-(trifluoromethyl)phenyl)methyl)amino)-1,2,3,4-tetrahydro-1-acridinol

Systematic Name

  • 1-Acridinol, 1,2,3,4-tetrahydro-6-fluoro-9-(((2-(trifluoromethyl)phenyl)methyl)amino)-

Registry Numbers

CAS Registry Number

  • 104628-35-5

System Generated Number

  • 0104628355

Structure Descriptors

InChI

1S/C21H18F4N2O/c22-13-8-9-14-17(10-13)27-16-6-3-7-18(28)19(16)20(14)26-11-12-4-1-2-5-15(12)21(23,24)25/h1-2,4-5,8-10,18,28H,3,6-7,11H2,(H,26,27)

InChIKey

LSWZHJUDTDSZPN-UHFFFAOYSA-N

Smiles

C1[C@@H](c2c(c3ccc(cc3nc2CC1)F)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.