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(S) -Modafinil

CAT: 0926-FM26032-02Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0926-FM26032-02Size:2 mg
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CAS Number
112111-47-4
Synonyms
2-[ (S) - (Diphenylmethyl) sulfinyl]acetamide; (+) -Modafinil; (S) - (+) -Modafinil
MDL Number
MFCD09841056
Smiles
C1=CC=C (C=C1) C (C2=CC=CC=C2) [S@@] (=O) CC (=O) N
Molecular Formula
C15H15NO2S
Molecular Weight
273.35 g/mol
Controlled
Yes

Chemical Information

Modafinil, (S)-

(S)-modafinil is a 2-[(diphenylmethyl)sulfinyl]acetamide that has S configuration at the sulfur atom. The racemate comprising (S)-modafinil and its enantiomer, armodafinil, is known as modafinil and is used for the treatment of sleeping disorders such as narcolepsy, obstructive sleep apnoea, and shift-work sleep disorder. The enantiomers have similar pharmacological actions in animals. It has a role as a central nervous system stimulant and a eugeroic. It is an enantiomer of an armodafinil.

CAS Number112111-47-4
PubChem CID11173366
IUPAC Name2-[(S)-benzhydrylsulfinyl]acetamide
Molecular FormulaC15H15NO2S
Molecular Weight273.4
XLogP1.7
Topological Polar Surface Area79.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count19
Formal Charge0
Complexity302
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)[S@@](=O)CC(=O)N
InChI
InChI=1S/C15H15NO2S/c16-14(17)11-19(18)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17)/t19-/m0/s1
InChIKey
YFGHCGITMMYXAQ-IBGZPJMESA-N
Chemical Structure
2D Structure
2D structure of Modafinil, (S)-
CAS: 112111-47-4
CID: 11173366
Formula: C15H15NO2S
MW: 273.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight273.4
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass273.08234989
Monoisotopic Mass273.08234989
Topological Polar Surface Area79.4 Ų
Heavy Atom Count19
Formal Charge0
Complexity302
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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