Basic information
- CAS
81982-32-3- Standard SMILES
C=CCN1CCCC1CNC(=O)c1cc(S(=O)(=O)NC)c(N)cc1OC- InChIKey
QRQMZZNDJGHPHZ-UHFFFAOYSA-N- Molecular formula
- C17H26N4O4S
- Average molar mass
- 382.5 g/mol
- Monoisotopic mass
- 382.1674765
Overview
Alpiropride is a member of benzenes and a sulfonamide.
Names & identifiers
- Preferred name
- 4-Amino-2-methoxy-5-((methylamino)sulfonyl)-N-((1-(2-propenyl)-2-pyrrolidinyl)methyl)benzamide
- IUPAC
- 4-amino-2-methoxy-5-(methylsulfamoyl)-N-[(1-prop-2-enylpyrrolidin-2-yl)methyl]benzamide
- English name
- alpiropride
- Molecular formula
- C17H26N4O4S
- Molecular weight
- 382.48
Names & synonyms
4-Amino-2-methoxy-5-((methylamino)sulfonyl)-N-((1-(2-propenyl)-2-pyrrolidinyl)methyl)benzamideRefChem:111424Alpiropride81982-32-3RevistelAlpiropride [INN]AlpiropridaRIV-2093Rivistel4-amino-2-methoxy-5-(methylsulfamoyl)-N-[(1-prop-2-enylpyrrolidin-2-yl)methyl]benzamide1768UW0XS1Alpiropridum [Latin]
Show more names
5-(Methylaminosulfonyl)-N-[(1-allyl-2-pyrrolidinyl)methyl]-2-methoxy-4-aminobenzamideBenzamide, 4-amino-2-methoxy-5-[(methylamino)sulfonyl]-N-[[1-(2-propen-1-yl)-2-pyrrolidinyl]methyl]-
Alpiroprida [Spanish]AlpiropridumEINECS 279-867-4Riv 2093UNII-1768UW0XS1ALPIROPRIDE [MI]N-(1-Allyl-2-pyrrolidinylmethyl)-2-methoxy-4-amino-5-methylsulfamoylbenzamideALPIROPRIDE [MART.]
Database identifiers
- CAS
81982-32-3- PubChem CID
- 71253
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 592
Experimental & physicochemical properties
LogP1.69
Physicochemical properties
- Melting point
- 168.5 · 168.5-169°
- Density
- 1.227 · 1.227±0.06 g/cm3(Predicted)
- pka
- 11 · 11+-.0.50(Predicted)
- FDA UNII
- 1768 UW0XS1 · 1768UW0XS1
- Toxicity
- 50 in · LD50 in male mice (mg/kg): 44 i.v.; 184 i.p.; 204 s.c.; 3600 orally (Perrot, Thominet, 1985)
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 in male mice (mg/kg): 44 i.v.; 184 i.p.; 204 s.c.; 3600 orally (Perrot, Thominet, 1985)
Chemistry & industry
Applications
DescriptionAlpiropride is a sulpiride-like dopamine antagonist reportedly useful in the treatment of migraine. Among the various sulpiride analogs, alpiropride has shown the largest separation between affinities for D2 and D4 binding sites in the brain.
Suppliers4 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Additional notes
DefinitionChEBI: Alpiropride is a sulfonamide and a member of benzenes.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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