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Acetohexamide

CAT: 0926-FA16951-03Size: 0.5 gDry Ice: NoHazardous: No
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CAS Number
968-81-0
Synonyms
4-Acetyl-N-[ (cyclohexylamino) carbonyl]benzenesulfonamide; Acetohexamid; Dimelin
MDL Number
MFCD00072156
Smiles
CC (=O) C1=CC=C (C=C1) S (=O) (=O) NC (=O) NC2CCCCC2
Molecular Formula
C15H20N2O4S
Molecular Weight
324.4 g/mol
Controlled
No

Chemical Information

Acetohexamide

Acetohexamide is an N-sulfonylurea that is urea in which a hydrogen attached to one of the nitrogens is replaced by a p-acetylphenylsulfonyl group, while a hydrogen attached to the other nitrogen is replaced by a cyclohexyl group. It has a role as a hypoglycemic agent and an insulin secretagogue. It is a member of acetophenones and a N-sulfonylurea.

CAS Number968-81-0
PubChem CID1989
IUPAC Name1-(4-acetylphenyl)sulfonyl-3-cyclohexylurea
Molecular FormulaC15H20N2O4S
Molecular Weight324.4
XLogP2.4
Topological Polar Surface Area101
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity498
SMILES
CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2CCCCC2
InChI
InChI=1S/C15H20N2O4S/c1-11(18)12-7-9-14(10-8-12)22(20,21)17-15(19)16-13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3,(H2,16,17,19)
InChIKey
VGZSUPCWNCWDAN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acetohexamide
CAS: 968-81-0
CID: 1989
Formula: C15H20N2O4S
MW: 324.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight324.4
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass324.11437830
Monoisotopic Mass324.11437830
Topological Polar Surface Area101 Ų
Heavy Atom Count22
Formal Charge0
Complexity498
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

Alternative Products

CatalogName
MBS3606868-01Acetohexamide
HY-W703629-01Acetohexamide-d11
A17745-50Acetohexamide 50mg
HY-B0881R-01Acetohexamide (Standard)
A17745-100Acetohexamide 100mg
A17745-500Acetohexamide 500mg
A17745-10mM-DAcetohexamide 10mM * 1mL in DMSO

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