Structure

Benfotiamine

CAS
22457-89-2
Catalog Number
ACM22457892
Category
Other Products
Molecular Weight
466.45
Molecular Formula
C19H23N4O6PS

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Specification

Description
Benfotiamine (rINN, or S-benzoylthiamine O-monophosphate) is a synthetic S-acyl derivative of thiamine (vitamin B1).It has been licensed for use in Germany since 1993 under the trade name Milgamma. (Combinations with pyridoxine or cyanocobalamin are also sold under this name.) It is prescribed there for treating sciatica and other painful nerve conditions.It is marketed as a medicine and/or dietary supplement, depending on the respective Regulatory Authority.
Synonyms
berdi;S-benzoylthiamine monophosphate;bietamine;biotamin;betivina
Melting Point
165ºC
Flash Point
404.4ºC
Density
1.444 g/cm³
Appearance
Shinning black powder
Hazard Codes
Xn
Hazard Statements
Xn
LogP
3.84720
PSA
191.5
Refractive Index
1.645
Safety Description
26-36
Storage Conditions
2-8ºC
Vapor Pressure
2.55E-23mmHg at 25°C
What is the molecular formula of Benfotiamine?

The molecular formula of Benfotiamine is C19H23N4O6PS.

What is the molecular weight of Benfotiamine?

The molecular weight of Benfotiamine is 466.4 g/mol.

When was Benfotiamine created?

Benfotiamine was created on 2005-08-08.

What is the role of Benfotiamine as?

Benfotiamine has a role as an immunological adjuvant, a nutraceutical, an antioxidant, a provitamin B1, and a protective agent.

What is the IUPAC Name of Benfotiamine?

The IUPAC Name of Benfotiamine is S-[(Z)-2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-phosphonooxypent-2-en-3-yl] benzenecarbothioate.

What is the Canonical SMILES of Benfotiamine?

The Canonical SMILES of Benfotiamine is CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCOP(=O)(O)O)SC(=O)C2=CC=CC=C2)C.

In which categories has Benfotiamine been investigated according to DrugBank?

Benfotiamine has been investigated for the treatment and prevention of Diabetic Nephropathy and Diabetes Mellitus, Type 2.

What is the InChIKey of Benfotiamine?

The InChIKey of Benfotiamine is BTNNPSLJPBRMLZ-LGMDPLHJSA-N.

What is the CAS number of Benfotiamine?

The CAS number of Benfotiamine is 22457-89-2.

How many hydrogen bond acceptor counts does Benfotiamine have?

Benfotiamine has 10 hydrogen bond acceptor counts.

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