Basic information
- CAS
565-33-3- Standard SMILES
Cc1ccc(S(=O)(=O)NC(=O)NC2CCCCC2)cc1N- InChIKey
XXYTXQGCRQLRHA-UHFFFAOYSA-N- Molecular formula
- C14H21N3O3S
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.13036271
Overview
Metahexamide is a member of benzenes and a sulfonamide.
Names & identifiers
- Preferred name
- Metahexamide
- IUPAC
- 1-(3-amino-4-methylphenyl)sulfonyl-3-cyclohexylurea
- English name
- metahexamide
- Molecular formula
- C14H21N3O3S
- Molecular weight
- 311.4
Names & synonyms
Metahexamide565-33-3GlyhexylamideMetahexamidaMetahexamidum1-(3-Amino-p-tolylsulfonyl)-3-cyclohexylureaT3U6F5D722DTXSID30232673-amino-N-[(cyclohexylamino)carbonyl]-4-methylbenzenesulfonamide3-Amino-N-((cyclohexylamino)carbonyl)-4-methylbenzenesulfonamideRefChem:8111963-(3-amino-4-methylbenzenesulfonyl)-1-cyclohexylurea
Show more names
WP-40S-1600MelonexMetahexanamide1-(3-amino-4-methyl-phenyl)sulfonyl-3-cyclohexyl-urea1-(3-azanyl-4-methyl-phenyl)sulfonyl-3-cyclohexyl-ureaBenzenesulfonamide, 3-amino-N-[(cyclohexylamino)carbonyl]-4-methyl-
DTXCID303267A10BB10209-276-91-(3-amino-4-methylphenyl)sulfonyl-3-cyclohexylurea3-Amino-4-methylbenzenesulfonylcyclohexylureaMethexamideEuglycin;Melanex;S-1600Methahexamide
Database identifiers
- CAS
565-33-3
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 455
Experimental & physicochemical properties
SpringerMaterials PropertiesCrystal structure
Physicochemical properties
- Melting point
- 151 °C · 151°C
- Boiling point
- 300 °C · 300°C (rough estimate)
- Density
- 1.2228 · 1.2228 (rough estimate)
- refractive index
- 1.674 · 1.6740 (estimate)
- storage temp.
- Refrigerator, under inert atmosphere
- solubility
- Methanol (Very Slightly)
- form
- Solid
- pka
- 5.49 · 5.49±0.10(Predicted)
- color
- White to Off-White
- FDA UNII
- 3 U6F5D722 · T3U6F5D722
- NCI Drug Dictionary
- metahexamide
- ATC code
- 10 BB10 · A10BB10
Chemistry & industry
Pharmacology
ATC Code
A - Alimentary tract and metabolism
QA - Alimentary tract and metabolism
Applications
UsesMetahexamide is used in biological studies to evaluate the elevation of blood urea nitrogen level in dogs and human subjects by administering chloral hypnotics.
Upstream & downstream products
Upstream raw materials
Suppliers4 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Additional notes
DefinitionChEBI: Metahexamide is a member of benzenes and a sulfonamide.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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