CAS 171596-32-0

(6R,12aR)-6-(1,3-Benzodioxol-5-yl)-2-cyclopentyl-2,3,6,7,12,12a-hexahydropyrazino[1′,2′:1,6]pyrido[3,4-b]indole-1,4-dione

Description:

The chemical substance with the name "(6R,12aR)-6-(1,3-Benzodioxol-5-yl)-2-cyclopentyl-2,3,6,7,12,12a-hexahydropyrazino[1′,2′:1,6]pyrido[3,4-b]indole-1,4-dione" and CAS number "171596-32-0" is a complex organic compound characterized by its unique bicyclic structure, which incorporates both a benzodioxole moiety and a hexahydropyrazino-pyridoindole framework. This compound exhibits a range of potential biological activities, making it of interest in medicinal chemistry. Its structural features suggest it may interact with various biological targets, potentially influencing pathways related to neuropharmacology or other therapeutic areas. The presence of multiple rings and functional groups contributes to its chemical reactivity and solubility properties. Additionally, the stereochemistry indicated by the (6R,12aR) configuration suggests specific spatial arrangements that may be crucial for its biological activity. Overall, this compound represents a fascinating example of synthetic organic chemistry with potential applications in drug development.

Formula: C₂₆H₂₅N₃O₄

InChI: InChI=1S/C26H25N3O4/c30-23-13-28(16-5-1-2-6-16)26(31)20-12-18-17-7-3-4-8-19(17)27-24(18)25(29(20)23)15-9-10-21-22(11-15)33-14-32-21/h3-4,7-11,16,20,25,27H,1-2,5-6,12-14H2/t20-,25-/m1/s1

InChI key: InChIKey=PWUCUSITNKSTMS-CJFMBICVSA-N

SMILES: O=C1N2[C@@H](C3=C(C=4C(N3)=CC=CC4)C[C@@]2(C(=O)N(C1)C5CCCC5)[H])C=6C=C7C(=CC6)OCO7

Synonyms:

• Pyrazino[1′,2′:1,6]pyrido[3,4-b]indole-1,4-dione, 6-(1,3-benzodioxol-5-yl)-2-cyclopentyl-2,3,6,7,12,12a-hexahydro-, (6R-trans)-
• Pyrazino[1′,2′:1,6]pyrido[3,4-b]indole-1,4-dione, 6-(1,3-benzodioxol-5-yl)-2-cyclopentyl-2,3,6,7,12,12a-hexahydro-, (6R,12aR)-
• (6R,12aR)-6-(1,3-Benzodioxol-5-yl)-2-cyclopentyl-2,3,6,7,12,12a-hexahydropyrazino[1′,2′:1,6]pyrido[3,4-b]indole-1,4-dione

Tadalafil Impurity 54

CAS: 171596-32-0

Formula: C₂₆H₂₅N₃O₄

Color and Shape: White To Off-White Solid

Molecular weight: 443.50

Ref: 4Z-T-1033

N-Desmethyl-N-cyclopentyl Tadalafil

Controlled Product

CAS: 171596-32-0

Applications N-Desmethyl-N-cyclopentyl Tadalafil is used as a reagent to synthesize tetracyclic cGMP-specific phosphodiesterase inhibitors, compounds that have potential to treat cardiovascular disorders and erectile dysfunction.
References Daugan, A. & Gellibert, F. Tetracyclic cGMP-specific Phosphodiesterase Inhibitors and Their Use in Disease Treatment. U.S. 6143746. Nov 7, 2000

Formula: C₂₆H₂₅N₃O₄

Color and Shape: Neat

Molecular weight: 443.49

Ref: TR-B199000

N-Desmethyl-N-cyclopentyl Tadalafil-D4

Controlled Product

CAS: 171596-32-0

Formula: C₂₆D₄H₂₁N₃O₄

Color and Shape: Neat

Molecular weight: 447.519

Ref: TR-B199002

N-Desmethyl-N-cyclopentyl tadalafil

CAS: 171596-32-0

N-Desmethyl-N-cyclopentyl tadalafil is an inhibitor of cyclic nucleotide phosphodiesterase (PDE) 5. It inhibits the breakdown of cGMP, which promotes vasodilation and erectile function by increasing blood flow to the penis. N-Desmethyl-N-cyclopentyl tadalafil has been shown to be a potent inhibitor of PDE5 with IC50 values in the low nanomolar range.

Formula: C₂₆H₂₅N₃O₄

Purity: Min. 95%

Molecular weight: 443.5 g/mol

Ref: 3D-WGA59632

Tadalafil Impurity 54

CAS: 171596-32-0

Formula: C₂₆H₂₅N₃O₄

Molecular weight: 443.5

Ref: ST-EA-CP-T31089