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Basic information
- CAS
968-81-0- Standard SMILES
CC(=O)c1ccc(S(=O)(=O)NC(=O)NC2CCCCC2)cc1- InChIKey
VGZSUPCWNCWDAN-UHFFFAOYSA-N- Molecular formula
- C15H20N2O4S
- Average molar mass
- 324.402 g/mol
- Monoisotopic mass
- 324.11437812
Names & identifiers
- Preferred name
- Acetohexamide
- IUPAC
- 4-Acetyl-N-(cyclohexylcarbamoyl)benzene-1-sulfonamide
- English name
- ACETOHEXAMIDE
- Molecular formula
- C15H20N2O4S
- Molecular weight
- 324.4
Names & synonyms
dymelorCyclamideu14812u-14812dimelindimelorminoralordimeltsiklamidDiMelor-d6
Database identifiers
- CAS
968-81-0- PubChem CID
- 1989
- DTXSID
DTXSID7020007- ChEMBL
CHEMBL1589- ChEBI
CHEBI:28052- UNII
- QGC8W08I6I
- EC Number
- 213-530-4
- Nikkaji
- J3.355C
Properties
Physicochemical properties
- Melting point
- 188 · 188-190° (GB 912789); mp 175-177° (Marshall)
- Density
- 1.2528 · 1.2528 (rough estimate)
- refractive index
- 1.693 · 1.6930 (estimate)
- storage temp.
- Refrigerator
- solubility
- 45 mg/mL · DMSO: ~45 mg/mL
- form
- solid
- pka
- 4.32 · 4.32±0.10(Predicted)
- color
- white
- Water Solubility
- 0.25 g/L · 0.25g/L(25 ºC)
- Major Application
- forensics and toxicologypharmaceutical (small molecule)
- 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
- SMILES
- CC(=O)c1ccc(cc1)S(=O)(=O)NC(=O)NC2CCCCC2
- Toxicology and Carcinogenesis
- Bioassay of Acetohexamide for Possible Carcinogenicity (CASRN 968-81-0)
- CAS DataBase Reference
- 968 · 968-81-0
- FDA UNII
- 8 W08I6I · QGC8W08I6I
- NCI Drug Dictionary
- acetohexamide
- ATC code
- 10 BB31 · A10BB31
- EPA Substance Registry System
- Acetohexamide (968-81-0)
- UNSPSC Code
- 41116107 · 41116107
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- Safety Statements
- 36 · 36
Safety & regulation
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- YR7350000
- Toxicity
- LD50 oral in rat: > 2gm/kg
- safety_code
- 36
- Storage Class
- 11 - Combustible Solids
- Hazardous Substances Data
- 968-81-0(Hazardous Substances Data)
Chemistry & industry
Applications
UsesAcetohexamide is a sulfonylurea derivative. Acetohexamide is a hyopglycemic agent with moderate uricosuric activity. Acetohexamide is a first generation medication used in the treatment of diabetes metilus type 2.
Usesantifungal
UsesLabelled Acetohexamide, a sulfonylurea derivative. Acetohexamide is a hyopglycemic agent with moderate uricosuric activity. Acetohexamide is a first generation medication used in the treatment of diab etes metilus type 2.
General DescriptionAcetohexamide is 4-acetyl-N-[(cyclohexylamino)carbonyl]benzenesulfonamide; or 1-[(p-acetylphenyl)sulfonyl]-3-cyclohexylurea; or 1-(p-acetylbenzenesulfonyl)-3-cyclohexylurea(generic). Acetohexamide incorporates the nearly optimal(for potency) cyclohexyl moiety in the “right-hand” sideof its molecular structure, but a p-acetyl substituent on the“left-side” benzene ring that decreases lipophilicity and israpidly biotransformed by reduction to an active metabolitethat is cleared relatively rapidly (see preceding discussion) independentlyof any P450s.
General DescriptionAcetohexamide, 1-[(p-acetylphenyl)sulfonyl]-3-cyclohexylurea (Dymelor), is relatedchemically and pharmacologically to tolbutamide and chlorpropamide.Like the other sulfonylureas, acetohexamidelowers the blood sugar level, primarily by stimulating the releaseof endogenous insulin.
General DescriptionWhite fluffy crystalline powder with almost no odor.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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