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CAS 869901-69-9

:

(6S)-2-[(3-Chloro-4-fluorophenyl)methyl]-8-ethyl-1,2,6,7,8,9-hexahydro-10-hydroxy-N,6-dimethyl-1,9-dioxopyrazino[1′,2′:1,5]pyrrolo[2,3-d]pyridazine-4-carboxamide

Description:
The chemical substance with the name "(6S)-2-[(3-Chloro-4-fluorophenyl)methyl]-8-ethyl-1,2,6,7,8,9-hexahydro-10-hydroxy-N,6-dimethyl-1,9-dioxopyrazino[1′,2′:1,5]pyrrolo[2,3-d]pyridazine-4-carboxamide" and CAS number "869901-69-9" is a complex organic compound characterized by its multi-cyclic structure and various functional groups. It features a hexahydro framework, indicating a saturated cyclic structure, along with a hydroxyl group and a carboxamide moiety, which contribute to its potential biological activity. The presence of halogen substituents, specifically chlorine and fluorine, suggests that the compound may exhibit unique electronic properties and interactions, potentially influencing its pharmacological profile. The stereochemistry indicated by the (6S) designation implies specific spatial arrangements of atoms, which can significantly affect the compound's reactivity and interaction with biological targets. Overall, this compound may be of interest in medicinal chemistry, particularly for its potential therapeutic applications, although specific biological activities would require further investigation through experimental studies.
Formula:C21H21ClFN5O4
InChI:InChI=1S/C21H21ClFN5O4/c1-4-26-8-10(2)28-16-14(18(29)17(28)21(26)32)20(31)27(25-15(16)19(30)24-3)9-11-5-6-13(23)12(22)7-11/h5-7,10,29H,4,8-9H2,1-3H3,(H,24,30)/t10-/m0/s1
InChI key:InChIKey=JSRREMIKIHJGAA-JTQLQIEISA-N
SMILES:C(NC)(=O)C=1C=2N3C(=C(O)C2C(=O)N(CC4=CC(Cl)=C(F)C=C4)N1)C(=O)N(CC)C[C@@H]3C
Synonyms:
  • Pyrazino[1′,2′:1,5]pyrrolo[2,3-d]pyridazine-4-carboxamide, 2-[(3-chloro-4-fluorophenyl)methyl]-8-ethyl-1,2,6,7,8,9-hexahydro-10-hydroxy-N,6-dimethyl-1,9-dioxo-, (6S)-
  • (6S)-2-[(3-Chloro-4-fluorophenyl)methyl]-8-ethyl-1,2,6,7,8,9-hexahydro-10-hydroxy-N,6-dimethyl-1,9-dioxopyrazino[1′,2′:1,5]pyrrolo[2,3-d]pyridazine-4-carboxamide
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