3-Bromo-N-((1-ethyl-2-pyrrolidinyl)methyl)-2-hydroxy-6-methoxybenzamide
Basic information
- CAS
84226-14-2- Standard SMILES
CCN1CCC[C@H]1CNC(=O)c1c(OC)ccc(Br)c1O- InChIKey
PWEZBNRZEHPIIQ-JTQLQIEISA-N- Molecular formula
- C15H21BrN2O3
- Average molar mass
- 357.24 g/mol
- Monoisotopic mass
- 356.07356
Names & identifiers
- Preferred name
- 3-Bromo-N-((1-ethyl-2-pyrrolidinyl)methyl)-2-hydroxy-6-methoxybenzamide
- IUPAC
- 3-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxybenzamide
- English name
- FLA 797
- Molecular formula
- C15H21BrN2O3
- Molecular weight
- 357.246
Names & synonyms
3-Bromo-N-((1-ethyl-2-pyrrolidinyl)methyl)-2-hydroxy-6-methoxybenzamideCHEMBL2830993-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxybenzamide3-bromo-n-{[(2s)-1-ethylpyrrolidin-2-yl]methyl}-2-hydroxy-6-methoxybenzamide(S)-3-Bromo-N-((1-ethylpyrrolidin-2-yl)methyl)-2-hydroxy-6-methoxybenzamide3-Bromo-N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-2-hydroxy-6-methoxybenzamide3-Bromo-N-{[(2S)-1-ethyl-2-pyrrolidinyl]methyl}-2-hydroxy-6-methoxybenzamideA 35043orb1740890SCHEMBL9549978BDBM50007534PDSP2_000912
Show more names
FLA 797A-35043
T685903-Bromo-N-(1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamide(-)-(s)-3-bromo-N-[-(1-ethyl-2-pyrrolidinyl)-methyl]-2-hydroxy-6-methoxybenzamide3-Bromo-N-((S)-1-ethyl-pyrrolidin-2-ylmethyl)-2-hydroxy-6-methoxy-benzamideBenzamide, 3-bromo-N-((1-ethyl-2-pyrrolidinyl)methyl)-2-hydroxy-6-methoxy-, (S)-
Database identifiers
- CAS
84226-14-2- PubChem CID
- 94688
- DTXSID
DTXSID80874701- ChEMBL
CHEMBL283099- Nikkaji
- J22.198H
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 356
Chemistry & industry
Applications
DescriptionFLA-797 is a Dopamine D2 receptor antagonist and metabolite of remoxipride.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…