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Substance Name: Hydroxystilbamidine [INN:BAN]
RN: 495-99-8
UNII: 39J262E49W
InChIKey: TUESWZZJYCLFNL-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C16-H16-N4-O

Molecular Weight

  • 280.3294
 
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Names and Synonyms

Results Name

  • Hydroxystilbamidine [INN:BAN]

Name of Substance

  • Hydroxystilbamidine
  • Hydroxystilbamidine [INN:BAN]

Synonyms

  • 2-Hydroxy-4,4'-diguanylstilbene
  • 2-Hydroxy-4,4'-stilbenedicarboxamidine
  • 4-10-00-02238 (Beilstein Handbook Reference)
  • BRN 2700919
  • EINECS 207-811-0
  • Hidroxiestilbamidina
  • Hidroxiestilbamidina [INN-Spanish]
  • Hydroxystilbamidine
  • Hydroxystilbamidinum
  • Hydroxystilbamidinum [INN-Latin]
  • Idrossistilbamidina
  • Idrossistilbamidina [DCIT]
  • Oxistilbamidinum
  • UNII-39J262E49W

Systematic Names

  • 4,4'-Stilbenedicarboxamidine, 2-hydroxy-
  • 4-(2-(4-Aminoiminomethyl)phenyl)ethenyl)-3-hydroxybenzenecarboximidamide
  • Benzenecarboximidamide, 4-(2-(4-(aminoiminomethyl)phenyl)ethenyl)-3-hydroxy- (9CI)

Registry Numbers

CAS Registry Number

  • 495-99-8

FDA UNII

  • 39J262E49W

System Generated Number

  • 0000495998

Structure Descriptors

InChI

1S/C16H16N4O/c17-15(18)12-5-2-10(3-6-12)1-4-11-7-8-13(16(19)20)9-14(11)21/h1-9,21H,(H3,17,18)(H3,19,20)

InChIKey

TUESWZZJYCLFNL-UHFFFAOYSA-N

Smiles

NC(=N)c1ccc(C=Cc2ccc(cc2O)C(=N)N)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 27mg/kg (27mg/kg)   United States Patent Document. Vol. #2510047,
mouse LD50 subcutaneous 140mg/kg (140mg/kg)   United States Patent Document. Vol. #2510047,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 235 deg C   EXP
log P (octanol-water) 1.560 (none)   EST
Atmospheric OH Rate Constant 1.72E-10 cm3/molecule-sec 25 EST

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