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Substance Name: Panidazole [INN:BAN]
RN: 13752-33-5
UNII: 08AHL2YV5K
InChIKey: ARYPMCPJIWUCIP-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C11-H12-N4-O2

Molecular Weight

  • 232.2418
 
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Names and Synonyms

Name of Substance

  • Panidazole
  • Panidazole [INN:BAN]

Synonyms

  • 4-(2-(2-Methyl-5-nitroimidazol-1-yl)ethyl)pyridine
  • 5-23-05-00076 (Beilstein Handbook Reference)
  • BRN 0533483
  • EINECS 237-334-3
  • Panidazol
  • Panidazol [INN-Spanish]
  • Panidazole
  • Panidazolum
  • Panidazolum [INN-Latin]
  • UNII-08AHL2YV5K

Systematic Names

  • 4-(2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl)pyridine (9CI)
  • 4-(2-(2-Methyl-5-nitroimidazol-1-yl)ethyl)pyridine
  • Panidazole
  • Pyridine, 4-(2-(2-methyl-5-nitroimidazol-1-yl)ethyl)-

Registry Numbers

CAS Registry Number

  • 13752-33-5

FDA UNII

  • 08AHL2YV5K

System Generated Number

  • 0013752335

Structure Descriptors

InChI

1S/C11H12N4O2/c1-9-13-8-11(15(16)17)14(9)7-4-10-2-5-12-6-3-10/h2-3,5-6,8H,4,7H2,1H3

InChIKey

ARYPMCPJIWUCIP-UHFFFAOYSA-N

Smiles

Cc1ncc(n1CCc2ccncc2)[N+](=O)[O-]

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.06 (none)   EXP
Water Solubility 2.14E+05 mg/L 25 EST
Vapor Pressure 2.33E-07 mm Hg 25 EST
Henry's Law Constant 4.89E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.21E-12 cm3/molecule-sec 25 EST

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