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CAS 178964-53-9

:

(3S)-9-Fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-7H-pyrido[1,2,3-de]-1,4-benzoxazin-7-one

Description:
(3S)-9-Fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-7H-pyrido[1,2,3-de]-1,4-benzoxazin-7-one, with CAS number 178964-53-9, is a chemical compound that belongs to the class of benzoxazines and is characterized by its complex bicyclic structure. This compound features a fluorine atom, which can influence its biological activity and lipophilicity. The presence of a piperazine moiety suggests potential interactions with biological targets, making it of interest in medicinal chemistry, particularly in the development of pharmaceuticals. The stereochemistry indicated by the (3S) designation implies specific spatial arrangements of atoms, which can significantly affect the compound's pharmacological properties. Additionally, the dihydro and methyl groups contribute to its overall reactivity and solubility characteristics. Overall, this compound's unique structural features may confer specific biological activities, warranting further investigation in drug discovery and development contexts.
Formula:C17H20FN3O2
InChI:InChI=1S/C17H20FN3O2/c1-11-10-23-17-15-12(14(22)3-4-21(11)15)9-13(18)16(17)20-7-5-19(2)6-8-20/h3-4,9,11H,5-8,10H2,1-2H3/t11-/m0/s1
InChI key:InChIKey=XTLCAWXSWVQNHK-NSHDSACASA-N
SMILES:O=C1C=2C3=C(C(=C(F)C2)N4CCN(C)CC4)OC[C@H](C)N3C=C1
Synonyms:
  • (3S)-9-Fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-7H-pyrido[1,2,3-de]-1,4-benzoxazin-7-one
  • 7H-Pyrido[1,2,3-de]-1,4-benzoxazin-7-one, 9-fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-, (S)-
  • 7H-Pyrido[1,2,3-de]-1,4-benzoxazin-7-one, 9-fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-, (3S)-
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