Basic information
- CAS
1219-20-1- Standard SMILES
CC[NH+](CC)CCc1nc(-c2ccccc2)no1.[Cl-]- InChIKey
YHLIBHCNFDRYFW-UHFFFAOYSA-N- Molecular formula
- C14H20ClN3O
- Average molar mass
- 281.78 g/mol
- Monoisotopic mass
- 281.12949
Overview
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Names & identifiers
- Preferred name
- 3-Phenyl-5-(beta-diethylaminoethyl)-1,2,4-oxadiazole hydrochloride
- IUPAC
- diethyl-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]azanium chloride
- English name
- (diethyl)[3-phenyl-1,2,4-oxadiazole-5-ethyl]ammonium chloride
- Molecular formula
- C14H20ClN3O
- Molecular weight
- 281.78
Names & synonyms
Oxolamine HCl683 M hydrochloridediethyl-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]azanium;chlorideAF 438 hydrochloride(Diethyl)(3-phenyl-1,2,4-oxadiazole-5-ethyl)ammonium chloride(diethyl)[3-phenyl-1,2,4-oxadiazole-5-ethyl]ammonium chlorideOxolamina cloridratoOxolamina cloridrato [Italian]EINECS 214-940-6UNII-SHI14LG2ZY3-Phenyl-5-(beta-diethylaminoethyl)-1,2,4-oxadiazole hydrochloride5-(2-(Diethylamino)ethyl)-3-phenyl-1,2,4-oxadiazole hydrochloride
Show more names
Oxolamine hydrochloride
5-(2-Dietilaminoetil)-3-fenil-1,2,4-oxadiezolo cloridrato [Italian]5-(2-Dietilaminoetil)-3-fenil-1,2,4-oxadiezolo cloridrato683 M hydrochloride, AF 438 hydrochloride, Oxolamine HCl, Oxolamine hydrochloride
Database identifiers
- CAS
1219-20-1
Properties
Computed structural properties
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 227
Physicochemical properties
- Melting point
- 153 · 153-154°
- FDA UNII
- 14 LG2ZY · SHI14LG2ZY
- Toxicity
- 50 oral · LD50 oral in rat: 1650mg/kg
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 oral in rat: 1650mg/kg
Chemistry & industry
Applications
UsesOxolamine (SKF-9976) hydrochloride is an orally active cough suppressant that can be used for the research of respiratory tract diseases. Oxolamine hydrochloride also exhibits anti-inflammatory effect[1][2].
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
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Compound notes
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