Basic information
- CAS
143137-35-3- Standard SMILES
Cn1cc(C(=O)C(=O)NC2CN3CCC2CC3)c2ccccc21- InChIKey
ZNAPADWWBWFMCQ-UHFFFAOYSA-N- Molecular formula
- C18H21N3O2
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.16337692
Names & identifiers
- Preferred name
- RS 56812
- IUPAC
- N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(1-methylindol-3-yl)-2-oxoacetamide
- English name
- (R)-N-(1-Azabicyclo[2.2.2]oct-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-oxoacetamide hydrochloride
- Molecular formula
- C18H21N3O2
- Molecular weight
- 311.38
Names & synonyms
143137-35-3X639VH5LHYRS-56812RS 56812RS56812RefChem:180072N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(1-methylindol-3-yl)-2-oxoacetamide(R)-N-(1-AZABICYCLO[2.2.2]OCT-3-YL)-2-(1-METHYL-1H-INDOL-3-YL)-2-(1-METHYL-1H-INDOL-3-YL)-2-OXOACETA(R)-N-(1-Azabicyclo[2.2.2]oct-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-oxoacetamide hydrochlorideSCHEMBL7379449DTXSID80398179N-(quinuclidin-3-yl)-2-(1-methyl-1 h-indol-3-yl)-2-oxo-acetamide
Show more names
RS56812HClRS 56812 HYDROCHLORIDE1H-Indole-3-acetamide, N-1-azabicyclo[2.2.2]oct-3-yl-1-methyl-α-oxo-(R)-N-(1-Azabicyclo[2.2.2]oct-3-yl)-2-(1-methyl-(1H-indol-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-oxoacetamidehydrochloride
1H-INDOLE-3-ACETAMIDE, N-1-AZABICYCLO(2.2.2)OCT-3-YL-1-METHYL-.ALPHA.-OXO-N-(1-Azabicyclo[2.2.2]oct-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-oxoacetamideN-(1-Azabicyclo[2.2.2]octan-3-yl)-2-(1-methyl-1H-indol-3-yl)-2-oxoacetamideN-1-AZABICYCLO(2.2.2)OCT-3-YL-1-METHYL-.ALPHA.-OXO-1H-INDOLE-3-ACETAMIDE
Database identifiers
- CAS
143137-35-3- PubChem CID
- 3950263
- DTXSID
DTXSID80398179- UNII
- X639VH5LHY
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 487
Physicochemical properties
- storage temp.
- Store at RT
- FDA UNII
- 639 VH5LHY · X639VH5LHY
Chemistry & industry
Applications
UsesRS 56812 is an extremely potent and selective SR-3 partial agonist. Ligand of 5-Hydroxytryptamine (5-HT3) receptor.
Suppliers2 total
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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