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Molecule

Fadine

CAS: 76824-35-6 · C8H15N7O2S3

2D Structure

3D Structure

Loading 3D structure...

Basic Information

CAS Registry Number
76824-35-6
Molecular Formula
C8H15N7O2S3
Molecular Mass
337.46 g/mol

Identifiers

CAS Registry Number

76824-35-6

SMILES

N=C(N)Nc1nc(CSCCC(=N)NS(N)(=O)=O)cs1

InChI Key

XUFQPHANEAPEMJ-UHFFFAOYSA-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)

Names and Synonyms

  • Fadine Synonym
  • Ulcatif Synonym
  • Famopsin Synonym
  • Sedanium R Synonym
  • Apogastine Synonym
  • H 2 Bloc Synonym
  • Supertidine Synonym
  • Tamin Synonym
  • Famodar Synonym
  • Famox Synonym
  • Quamatel Synonym
  • Digervin Synonym
  • FamoABZ Synonym
  • Quamtel Synonym
  • Ulped Synonym
  • Ulcedine Synonym
  • Ulcidine Synonym
  • Fuweidin Synonym
  • Mosul Synonym
  • Ulceran Synonym
  • Apo-Famotidine Synonym
  • Purifam Synonym
  • Famo Synonym
  • Logos Synonym
  • Peptifam Synonym
  • Fenox Synonym
  • Famonerton Synonym
  • Famos Synonym
  • Gastro Synonym
  • Durater Synonym
  • Panalba Synonym
  • Famodin Synonym
  • Gastrodomina Synonym
  • Restadin Synonym
  • Pepfamin Synonym
  • Dispronil Synonym
  • Ulfagel Synonym
  • Weimok Synonym
  • Pepcidin Synonym
  • Fudone Synonym
  • Fagastine Synonym
  • Famowal Synonym
  • Famotin Synonym
  • Famotal Synonym
  • Gastrion Synonym
  • Fanox Synonym
  • Topcid Synonym
  • Ulped AR Synonym
  • Ulcofam Synonym
  • Fadin Synonym
  • Bestidine Synonym
  • Pepzan Synonym
  • Kemofam Synonym
  • Brolin Synonym
  • Famotep Synonym
  • Pepdif Synonym
  • Ulfam Synonym
  • Dibrit 40 Synonym
  • Rogasti Synonym
  • Pepcidin Rapitab Synonym
  • Agufam Synonym
  • Antodine Synonym
  • Famogard Synonym
  • Facid Synonym
  • Farmotex Synonym
  • Fadyn Synonym
  • Cepal Synonym
  • Famocid Synonym
  • Famostagine-D Synonym
  • Servipep Synonym
  • Peptec Synonym
  • Famolta Synonym
  • Famoser Synonym
  • Mabo Synonym
  • Famotidine Synonym
  • Motiax Synonym
  • Ulcetrax Synonym
  • Ganor Synonym
  • Ulfamid Synonym
  • Famodil Synonym
  • Famoxal Synonym
  • Nulcerin Synonym
  • Amfamox Synonym
  • Pepcidina Synonym
  • Pepcidine Synonym
  • Dispromil Synonym
  • Lecedil Synonym
  • Pepcid Synonym
  • Pepdine Synonym
  • Fanosin Synonym
  • Fibonel Synonym
  • Famosan Synonym
  • Peptan Synonym
  • Gastropen Synonym
  • Muclox Synonym
  • Pepcid PM Synonym
  • Pepdul Synonym
  • Ifada Synonym
  • Famodine Synonym
  • Pepcid AC Synonym
  • Pepdul mite Synonym
  • Ganor mite Synonym
  • Nevofam Synonym
  • Famogast Synonym
  • 3-[[2-(Diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]-N′-sulfamoylpropanimidamide Synonym
  • 3-[([2-[(Diaminomethylidene)amino]-1,3-thiazol-4-yl]methyl)sulfanyl]-N-sulfamoylpropanimidamide Synonym
  • Propanimidamide, 3-[[[2-[(aminoiminomethyl)amino]-4-thiazolyl]methyl]thio]-N-(aminosulfonyl)- Synonym
  • 3-[[[2-[(Aminoiminomethyl)amino]-4-thiazolyl]methyl]thio]-N-(aminosulfonyl)propanimidamide Synonym
  • YM 11170 Synonym
  • 3-[(2-Diaminomethyleneaminothiazol-4-yl)methylthio]-N-sulfamoylpropionamidine Synonym
  • Famotidine Synonym
  • MK 208 Synonym
  • N-(Aminosulfonyl)-3-[[[2-[(diaminomethylene)amino]-4-thiazolyl]methyl]thio]propanimidamide Synonym
  • Gaster Synonym
  • Gastridin Synonym
  • Ulfinol Synonym

All Properties

Comprehensive physical and chemical properties

Property Value Source
Molecular Mass 337.46 g/mol CAS Common Chemistry
337.4560000000001 g/mol RDKit
337.456 g/mol RDKit
Canonical SMILES O=S(=O)(N)NC(=N)CCSCC=1N=C(SC1)NC(=N)N CAS Common Chemistry
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) CAS Common Chemistry
InChI Key InChIKey=XUFQPHANEAPEMJ-UHFFFAOYSA-N CAS Common Chemistry
Melting Point 163-164 °C CAS Common Chemistry
Name Famotidine CAS Common Chemistry
Heavy Atom Count 20 RDKit
Hydrogen Bond Acceptors 7 RDKit
Hydrogen Bond Donors 6 RDKit
Rotatable Bonds 7 RDKit
Aromatic Ring Count 1 RDKit
Topological Polar Surface Area 170.83 Ų RDKit
LogP -0.15785999999999956 RDKit
-0.1579 RDKit
Molar Refractivity 82.3994 cm³/mol RDKit
Ring Count 1 RDKit
Formal Charge 0 RDKit
Fraction Csp3 0.375 RDKit
Exact Mass 337.04493571999996 g/mol RDKit

Spectral Data

NMR, IR, and Mass spectral data

Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

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MW = 337.46 g/mol. Edit any field — others recompute live.

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