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76824-35-6

76824-35-6 structural image
Product Name: Famotidine
Formula: C8H15N7O2S3
Synonyms: {3-[((2-((Aminoiminomethyl)amino)-4-thiazolyl)methyl)thio]-N′-(aminosulfonyl)propaneimidamide};N′-(Aminosulfonyl)-3-([2-(diaminomethyleneamino)-4-thiazolyl]methylthio)propanamidine;Famotidine
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form White to pale yellow crystals
Melting Point 163-164 °C
Solubility Solubility at 20 °C (% w/v): 80 in DMF; 50 in acetic acid; 0.3 in methanol; 0.1 in water; <0.01 in ethanol, ethyl acetate, chloroform
LogP logP = -0.57, measured at pH 9.2
Chemical Classes Other Uses -> Pharmaceuticals

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H303:Acute toxicity,oral
Precautionary Statement Codes P270:Do not eat, drink or smoke when using this product.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P403:Store in a well-ventilated place.

COMPUTED DESCRIPTORS

Molecular Weight 337.5 g/mol
XLogP3 -0.6
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 7
Exact Mass 337.04493627 g/mol
Monoisotopic Mass 337.04493627 g/mol
Topological Polar Surface Area 238 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 469
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Famotidine is a compound that has been extensively studied in the context of its interaction with histamine H2 receptors. In research environments, the focus on Famotidine often centers on the elucidation of receptor-ligand interactions within the gastrointestinal system. Investigations into the mechanism of action of Famotidine involve the exploration of how it binds to and influences the activity of H2 receptors, which are implicated in the regulation of gastric acid secretion.

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