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Substance Name: Compound 348U87
RN: 127142-14-7
UNII: 90OV2WY8JF
InChIKey: YYLKOELWSMRYHV-UHFFFAOYSA-N

Note

  • Antiherpes cpd.

Molecular Formula

  • C15-H15-Cl-N6-S2

Molecular Weight

  • 378.91
 
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Names and Synonyms

Name of Substance

  • Compound 348U87

Synonyms

  • 2-Actylpyridine 5-((2-chloroanilino)thiocarbonyl)thiocarbonohydrazone
  • 348 U87
  • 348U87
  • BW 348U87
  • UNII-90OV2WY8JF

Systematic Name

  • Carbonothioic dihydrazide, 2-(((2-chlorophenyl)amino)thioxomethyl)-21-(1-(2-pyridinyl)ethylidene)-

Registry Numbers

CAS Registry Number

  • 127142-14-7

FDA UNII

  • 90OV2WY8JF

System Generated Number

  • 0127142147

Structure Descriptors

InChI

1S/C15H15ClN6S2/c1-10(12-7-4-5-9-17-12)19-21-15(24)22-20-14(23)18-13-8-3-2-6-11(13)16/h2-9H,1H3,(H2,18,20,23)(H2,21,22,24)

InChIKey

YYLKOELWSMRYHV-UHFFFAOYSA-N

Smiles

n1ccccc1\C(C)=N\NC(=S)NNC(=S)Nc1ccccc1Cl

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.67 (none)   EXP
Water Solubility 21.7 mg/L 25 EST
Vapor Pressure 6.60E-11 mm Hg 25 EST
Henry's Law Constant 4.63E-15 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.02E-10 cm3/molecule-sec 25 EST

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