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Substance Name: Nitracrine [INN]
RN: 4533-39-5
UNII: 712MLZ30SB
InChIKey: YMVWGSQGCWCDGW-UHFFFAOYSA-N

Note

  • Acridine antineoplastic agent used in mammary and ovarian tumors. It inhibits RNA synthesis.

Molecular Formula

  • C18-H20-N4-O2

Molecular Weight

  • 324.382
 

Classification Codes

  • Antineoplastic Agents
  • Drug / Therapeutic Agent
  • Enzyme Inhibitors
  • Mutation Data
  • Nucleic Acid Synthesis Inhibitors
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Names and Synonyms

Name of Substance

  • Nitracrine
  • Nitracrine [INN]

MeSH Heading

  • Nitracrine

Synonyms

  • 1-Nitro-9-(3'-dimethylaminopropylamino)-acridine
  • 9-((3-(Dimethylamino)propyl)amino)-1-nitroacridine
  • C 283
  • CCRIS 1973
  • Nitracrina
  • Nitracrina [INN-Spanish]
  • Nitracrine
  • Nitracrinum
  • Nitracrinum [INN-Latin]
  • UNII-712MLZ30SB

Systematic Names

  • 1,3-Propanediamine, N,N-dimethyl-N'-(1-nitro-9-acridinyl)- (9CI)
  • 1-Nitro-9-(dimethylaminopropylamino)acridine
  • 9-((3-(Dimethylamino)propyl)amino)-1-nitroacridine
  • Acridine, 9-(3-(dimethylamino)propylamino)-1-nitro-

Registry Numbers

CAS Registry Number

  • 4533-39-5

FDA UNII

  • 712MLZ30SB

System Generated Number

  • 0004533395

Structure Descriptors

InChI

1S/C18H20N4O2/c1-21(2)12-6-11-19-18-13-7-3-4-8-14(13)20-15-9-5-10-16(17(15)18)22(23)24/h3-5,7-10H,6,11-12H2,1-2H3,(H,19,20)

InChIKey

YMVWGSQGCWCDGW-UHFFFAOYSA-N

Smiles

CN(C)CCCNc1c2ccccc2nc3c1c(ccc3)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 97ug/kg (0.097mg/kg)   Journal of Medicinal Chemistry. Vol. 39, Pg. 2508, 1996.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 134.5 deg C   EXP
pKa Dissociation Constant 6.45 (none)   EXP
log P (octanol-water) 2.950 (none)   EST
Atmospheric OH Rate Constant 1.09E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.