Dimetipirium Bromide
Basic information
- CAS
51047-24-6- Standard SMILES
CC1CCC(C)[N+]1(C)CCOC(=O)C(O)(c1ccccc1)c1ccccc1.[Br-]- InChIKey
OAOFTCGGCRBLAW-UHFFFAOYSA-M- Molecular formula
- C23H30BrNO3
- Average molar mass
- 448.4 g/mol
- Monoisotopic mass
- 447.14091
Names & identifiers
- Preferred name
- Dimetipirium Bromide
- IUPAC
- 2-(1,2,5-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-hydroxy-2,2-diphenylacetate bromide
- English name
- Dimetipirium
- Molecular formula
- C23H30BrNO3
- Molecular weight
- 448.3932
Names & synonyms
Dimetipirium bromideUNII-0WVM2U8MFIDimetipirium bromide [INN]51047-24-60WVM2U8MFIbromuro de dimetipiriobromure de dimetipirium1-(2-Benziloyloxyethyl)-1,2,5-trimethylpyrrolidinium bromide1-(2-Hydroxyethyl)-1,2,5-trimethylpyrrolidinium bromide benzilatePyrrolidinium, 1-(2-benziloyloxyethyl)-1,2,5-trimethyl-, bromidePYRROLIDINIUM, 1-(2-((2-HYDROXY-2,2-DIPHENYLACETYL)OXY)ETHYL)-1,2,5-TRIMETHYL-, BROMIDE (1:1)dimAtipirium
Show more names
Dimetipirium
dimetipirii bromidumRefChem:134399orb2815721SCHEMBL2733698CHEMBL2104304DTXSID909653312-(1,2,5-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-hydroxy-2,2-diphenylacetate bromideNS00126680
Database identifiers
- CAS
51047-24-6- PubChem CID
- 176161
- DTXSID
DTXSID90965331- ChEMBL
CHEMBL2104304- UNII
- 0WVM2U8MFI
Properties
Computed structural properties
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 466
Physicochemical properties
- FDA UNII
- 0 WVM2U8MFI · 0WVM2U8MFI
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Compound notes
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