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Famotidine propanamide

CAT: 0931-T68725-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T68725-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
76824-16-3
Target
Others
Related Pathways
Others
Bioactivity
Famotidine propanamide is a histamine H2-receptor antagonist that inhibits stomach acid production. It is commonly used in the treatment of peptic ulcer disease and gastroesophageal reflux disease.
Smiles
N(C(=N)N)C1=NC(CSCCC(N)=O)=CS1
Molecular Formula
C8H13N5OS2
Molecular Weight
259.35
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Famotidine propanamide
CAS Number76824-16-3
PubChem CID12760738
IUPAC Name3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]propanamide
Molecular FormulaC8H13N5OS2
Molecular Weight259.4
XLogP0.2
Topological Polar Surface Area174
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count16
Formal Charge0
Complexity269
SMILES
C1=C(N=C(S1)N=C(N)N)CSCCC(=O)N
InChI
InChI=1S/C8H13N5OS2/c9-6(14)1-2-15-3-5-4-16-8(12-5)13-7(10)11/h4H,1-3H2,(H2,9,14)(H4,10,11,12,13)
InChIKey
BLXXXPVCYVHTQA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Famotidine propanamide
CAS: 76824-16-3
CID: 12760738
Formula: C8H13N5OS2
MW: 259.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight259.4
XLogP30.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass259.05615240
Monoisotopic Mass259.05615240
Topological Polar Surface Area174 Ų
Heavy Atom Count16
Formal Charge0
Complexity269
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes