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Substance Name: 1,3,5-Diazaphosphorinium, 1,3-bis(4-methylphenyl)-5-(((4-methylphenyl)amino)methyl)-5-phenyl-, chloride
RN: 85684-45-3
InChIKey: SMXBYYZTHXJPGX-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H35-N3-P.Cl

Molecular Weight

  • 516.0655
 
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Names and Synonyms

  • 1,3,5-Diazaphosphorinium, 1,3-bis(4-methylphenyl)-5-(((4-methylphenyl)amino)methyl)-5-phenyl-, chloride

Registry Numbers

CAS Registry Number

  • 85684-45-3

System Generated Number

  • 0085684453

Molecular Formulas

Molecular Formula

  • C31-H35-N3-P.Cl

Molecular Formula Fragments

  • C31-H35-N3-P
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C31H35N3P.ClH/c1-25-9-15-28(16-10-25)32-21-35(31-7-5-4-6-8-31)23-33(29-17-11-26(2)12-18-29)22-34(24-35)30-19-13-27(3)14-20-30;/h4-20,32H,21-24H2,1-3H3;1H/q+1;/p-1

InChIKey

SMXBYYZTHXJPGX-UHFFFAOYSA-M

Smiles

Cc1ccc(cc1)NC[P+]2(CN(CN(C2)c3ccc(cc3)C)c4ccc(cc4)C)c5ccccc5.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 240mg/kg (240mg/kg)   Pharmaceutical Chemistry Journal Vol. 17, Pg. 206, 1983.