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CAS 620948-34-7

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Cyclopenta[4,5]pyrido[3,2,1-jk][1,4]benzodiazepine, 4,5,6,7,9,9a,10,11,12,12a-decahydro-, hydrochloride (1:1), (9aR,12aS)-

Description:
Cyclopenta[4,5]pyrido[3,2,1-jk][1,4]benzodiazepine, specifically the hydrochloride salt form with the designation (1:1) and stereochemistry (9aR,12aS), is a complex organic compound characterized by its fused bicyclic structure that incorporates both benzodiazepine and pyridine moieties. This compound features a decahydro configuration, indicating a fully saturated structure with multiple chiral centers, which contributes to its stereochemical specificity. The hydrochloride salt form enhances its solubility in aqueous environments, making it more suitable for biological applications. Such compounds are often investigated for their potential pharmacological properties, including anxiolytic, sedative, or anticonvulsant effects, due to the presence of the benzodiazepine framework. The unique arrangement of its rings and substituents may also influence its interaction with biological targets, such as neurotransmitter receptors. As with many synthetic compounds, safety and efficacy assessments are crucial for any therapeutic applications. Further research is necessary to fully elucidate its properties and potential uses in medicinal chemistry.
Formula:C15H20N2·ClH
InChI:InChI=1S/C15H20N2.ClH/c1-3-11-9-16-7-8-17-10-12-4-2-5-13(12)14(6-1)15(11)17;/h1,3,6,12-13,16H,2,4-5,7-10H2;1H/t12-,13-;/m0./s1
InChI key:InChIKey=PYPPENBDXAWXJC-QNTKWALQSA-N
SMILES:C1=2C=3N(C[C@]4([C@@]1(CCC4)[H])[H])CCNCC3C=CC2.Cl
Synonyms:
  • Vabicaserin hydrochloride
  • Cyclopenta[4,5]pyrido[3,2,1-jk][1,4]benzodiazepine, 4,5,6,7,9,9a,10,11,12,12a-decahydro-, monohydrochloride, (9aR,12aS)-
  • Cyclopenta[4,5]pyrido[3,2,1-jk][1,4]benzodiazepine, 4,5,6,7,9,9a,10,11,12,12a-decahydro-, hydrochloride (1:1), (9aR,12aS)-
  • SCA 136
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