3-[({2-[(Diaminomethylene)amino]-1,3-thiazol-4-yl}methyl)sulfanyl]-N'-sulfamoylpropanimidamide | CAS No. 76824-35-6

3-[({2-[(Diaminomethylene)amino]-1,3-thiazol-4-yl}methyl)sulfanyl]-N'-sulfamoylpropanimidamide

Basic Information

CAS Number

76824-35-6

Molecular Formula

C8H15N7O2S3

Molecular Weight

337.46 g/mol

AD

Basic Physical Properties

Melting Point

163-164 ºC

Boiling Point

662.4±65.0 °C at 760 mmHg

Density

1.5111 (rough estimate)

Water Solubility

1.1 mg/mL

Flash Point

150℃

Solubility

DMSO 67 mg/mL (198.54 mM);Water <1 mg/mL (<1 mM);Ethanol <1 mg/mL (<1 mM)

Refractive Index

1.7400 (estimate)

C1=C(N=C(S1)N=C(N)N)CSCCC(=NS(=O)(=O)N)N

InChI

InChI=1S/C8H15N7O2S3/c9-6(15-20(12,16)17)1-2-18-3-5-4-19-8(13-5)14-7(10)11/h4H,1-3H2,(H2,9,15)(H2,12,16,17)(H4,10,11,13,14)

InChIKey

XUFQPHANEAPEMJ-UHFFFAOYSA-N

LogP

-0.5583299999999984

Topological Polar Surface Area

173.33 Ų

Hydrogen Bond Donor/Acceptor

8 / 9

Complexity

469

Safety Information

View Safety Information

GHS Hazard Pictograms

H303

Hazard Statement

H303 May be harmful if swallowed
Acute toxicity, oral

Toxicity

LD50 i.v. in mice: 244.4 mg/kg (Yasufumi)

Synonyms & References

English

  • NCGC00093899-03
  • NCGC00018276-01
  • Antodine
  • Sigafam
  • FAMOTIDINE (MART.)
  • Topcare Acid Reducer
  • NCGC00015446-08
  • HSDB 3572
  • SR-05000001440
  • PEPCID COMPLETE COMPONENT FAMOTIDINE
  • Fudone
  • NCGC00015446-01
  • 3-(((2-((Diaminomethylene)amino)thiazol-4-yl)methyl)thio)-N'-sulfamoylpropanimidamide
  • Farmotex
  • Pepcidin Rapitab
  • 3-(2-(Diaminomethyleneamino)-1,3-thiazol-4-yl)methylthio)-N'- sulfamoylpropionamidine
  • CCG-220104
  • 3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]-N'-sulfamoylpro
  • Famo
  • Pepcidine
  • heartburn preventionoriginal strength
  • Hacip
  • HMS1568E10
  • NCGC00015446-06
  • Supertidine
  • Zantac 360 Cool Mint
  • AC-11713
  • BPBio1_000098
  • Peptan
  • MFCD00079297
  • Gastrion

MDL Number

MFCD00079297

Customs Code

2935009090

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