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Substance Name: as-Triazine, 1,4,5,6-tetrahydro-3-(o-chlorophenyl)-1,6-dimethyl-5-phenyl-, monohydrochloride, trans-(+)-
RN: 14153-49-2
InChIKey: HLLZHPMCDAEGHD-KKJWGQAZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-Cl-N3.Cl-H

Molecular Weight

  • 336.264
 
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Names and Synonyms

  • as-Triazine, 1,4,5,6-tetrahydro-3-(o-chlorophenyl)-1,6-dimethyl-5-phenyl-, monohydrochloride, trans-(+)-

Registry Numbers

CAS Registry Number

  • 14153-49-2

System Generated Number

  • 0014153492

Molecular Formulas

Molecular Formula

  • C17-H18-Cl-N3.Cl-H

Molecular Formula Fragments

  • C17-H18-Cl-N3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H18ClN3.ClH/c1-12-16(13-8-4-3-5-9-13)19-17(20-21(12)2)14-10-6-7-11-15(14)18;/h3-12,16H,1-2H3,(H,19,20);1H/t12-,16+;/m1./s1

InChIKey

HLLZHPMCDAEGHD-KKJWGQAZSA-N

Smiles

N1=C(N[C@@H]([C@H](N1C)C)c1ccccc1)c1c(cccc1)Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 881, 1966.