Methadyl Acetate
Basic information
- CAS
509-74-0- Standard SMILES
CCC(OC(C)=O)C(CC(C)N(C)C)(c1ccccc1)c1ccccc1- InChIKey
XBMIVRRWGCYBTQ-UHFFFAOYSA-N- Molecular formula
- C23H31NO2
- Average molar mass
- 353.5 g/mol
- Monoisotopic mass
- 353.23547923
Overview
Acetylmethadol is a diarylmethane.
Names & identifiers
- Preferred name
- Methadyl Acetate
- IUPAC
- [6-(dimethylamino)-4,4-diphenylheptan-3-yl] acetate
- English name
- acetylmethadol
- Molecular formula
- C23H31NO2
- Molecular weight
- 353.51
Names & synonyms
Methadyl acetateAcetylmethadolAcetilmetadolAcetylmethadolum509-74-03-Acetoxy-6-dimethylamino-4,4-diphenylheptaneL59OC40KWJACSCN-9601IDS-NA-004NIH-2953Benzeneethanol, beta-(2-(dimethylamino)propyl)-alpha-ethyl-beta-phenyl-, acetate (ester)DTXSID2023274
Show more names
AcemethadoneAmidolacetateRace-AcetylmethadolALPHA-ACETYLMETHADOLAcetylmethadol 13CD3XBMIVRRWGCYBTQ-UHFFFAOYSA-N6-dimethylamino-4,4-diphenyl-3-acetoxyheptane[6-(dimethylamino)-4,4-di(phenyl)heptan-3-yl] acetate
6-(dimethylamino)-4,4-diphenylheptan-3-yl acetate6-(Dimethylamino)-4,4-Diphenyl-3-Heptanol AcetateRefChem:156848DTXCID403274208-103-4Acetilmetadol [INN-Spanish]Acetylmethadolum [INN-Latin]Methadyl acetate [USAN]
Database identifiers
- CAS
509-74-0- PubChem CID
- 10517
- DTXSID
DTXSID2023274- ChEMBL
CHEMBL170179- ChEBI
CHEBI:135491- UNII
- L59OC40KWJ
- EC Number
- 208-103-4
- Nikkaji
- J20.711J、J6.254E
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 404
Experimental & physicochemical properties
Drugs
DEA NFLIS-Drug Category -> Narcotic Analgesics
DEA Schedule I Controlled Substance -> Opiates
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
LogP
4.27
4.27
Endocrine DisruptorsPotential endocrine disrupting compound
Physical DescriptionSolid
Physicochemical properties
- Boiling point
- 456 · 456.0±45.0 °C(Predicted)
- Density
- 1.02 · 1.020±0.06 g/cm3(Predicted)
- pka
- 9.4 · 9.40±0.50(Predicted)
- FDA UNII
- 59 OC40KWJ · L59OC40KWJ
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationDEA schedule I controlled substance
Chemistry & industry
Pharmacology
PharmacodynamicsMethadyl Acetate is a narcotic analgesic with a long onset and duration of action. The drug decreases a patients opioid use by preventing opioid withdrawal and in how it can mimic some of the effects of opioids.
Mechanism of ActionMethadyl Acetate is primarily a mu-type opioid receptor agonist. It functions similarily to methadone.
MeSH Pharmacological ClassificationCompounds with activity like OPIATE ALKALOIDS, acting at OPIOID RECEPTORS. Properties include induction of ANALGESIA or NARCOSIS.
Cellular LocationsMembrane
Metabolite PathwaysMethadyl Acetate Action Pathway
Applications
UsesAnalgesic (narcotic).
Upstream & downstream products
Upstream raw materials
Suppliers
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Related reactions
1 records
Compound notes
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