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Chemical structure of Cimetidine sulfoxide

GC62267

Cimetidine sulfoxide

Also known as 1-cyano-2-methyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfinyl]ethyl]guanidine

Cimetidine sulfoxide (Cimetidine sulphoxide) is a sulfoxide metabolite of Cimetidine

ChemicalCAS54237-72-8MW268.34FormulaC10H16N6OS
CAS number
54237-72-8
Molecular weight
268.34
Formula
C10H16N6OS
Solubility
DMSO : 83·33 mg/mL (310·54 mM; ultrasonic and warming and heat to 60°C)
InChIKey
HOJLJLYVNQFCRE-UHFFFAOYSA-N
Catalogue number
GC62267
Brand
GLPBIO
Computed properties PubChem CID 62949 · XLogP -1.1 · TPSA 125 Ų · H-bond donors 3
XLogP
-1.1
TPSA
125 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
18

SMILES CC1=C(N=CN1)CS(=O)CCNC(=NC)NC#N

Computed descriptors from PubChem (CID 62949), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
Ships from the manufacturer to your lab in 8–14 business days; customs and cold chain handled by LABO Scientific.
Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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