Basic information
- CAS
57661-45-7- Standard SMILES
O=C(c1ccc(Cl)cc1)[C@@H]1CCN2CCCC[C@H]2C1- InChIKey
FXZJUVNEMFIWMF-HIFRSBDPSA-N- Molecular formula
- C16H20ClNO
- Average molar mass
- 277.79 g/mol
- Monoisotopic mass
- 277.123342
Overview
RN given for (cis)-isomer; structure given in first source
Names & identifiers
- Preferred name
- Hsr 740
- IUPAC
- [(2R,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl]-(4-chlorophenyl)methanone
- English name
- HSR 740
- Molecular formula
- C16H20ClNO
- Molecular weight
- 277.79
Names & synonyms
Hsr 740Hsr-74057661-45-7DTXSID20206365RefChem:146868DTXCID20128856trans(3H,9aH)-3-(4-Chloro)benzoylquinolizidineMethanone, (4-chlorophenyl)(octahydro-2H-quinolizin-2-yl)-, cis-(4-Chlorophenyl)[(2R,9aS)-octahydro-2H-quinolizin-2-yl]methanoneMethanone, (4-chlorophenyl)(octahydro-2H-quinolizin-2-yl)-, cis- (9CI)
Database identifiers
- CAS
57661-45-7- PubChem CID
- 205960
- DTXSID
DTXSID20206365
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 325
Chemistry & industry
Applications
DescriptionHSR-740 is a quinolizidine derivative which acts as a strong central depressant agent.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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