Chem
J-GLOBAL ID：200907080168222401   Nikkaji number：J2.707.635A

BFF-122

(3S)-10-(4-アミノピペラジン-1-イル)-9-フルオロ-3-メチル-7-オキソ-2,3,6,7-テトラヒドロ-5H-ピリド[1,2,3-de]-1,4-ベンゾオキサジン-6-カルボン酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C17H21FN4O4
Molecular formula furigana： C17-H21-F-N4-O4
Molecular weight： 364.377
InChI： InChI=1S/C17H21FN4O4/c1-9-8-26-16-13-10(15(23)11(17(24)25)7-22(9)13)6-12(18)14(16)20-2-4-21(19)5-3-20/h6,9,11H,2-5,7-8,19H2,1H3,(H,24,25)/t9-,11?/m0/s1
InChI key： SBYIJFJAUBGBOA-FTNKSUMCSA-N
SMILES： C[C@H]1COc2c(N3CCN(N)CC3)c(F)cc3C(=O)C(CN1c23)C(=O)O
Systematic name  (3)：
  • (3S)-10-(4-アミノピペラジン-1-イル)-9-フルオロ-3-メチル-7-オキソ-2,3,6,7-テトラヒドロ-5H-ピリド[1,2,3-de]-1,4-ベンゾオキサジン-6-カルボン酸
  • (2S)-6-(4-アミノピペラジン-1-イル)-7-フルオロ-2-メチル-10-オキソ-4-オキサ-1-アザトリシクロ[7.3.1.05,13]トリデカ-5,7,9(13)-トリエン-11-カルボン酸
  • (2S)-6-(4-aminopiperazin-1-yl)-7-fluoro-2-methyl-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-11-carboxylic acid
Other name (2)：
  • (3S)-10-(4-Aminopiperazine-1-yl)-9-fluoro-3-methyl-7-oxo-2,3,6,7-tetrahydro-5H-pyrido[1,2,3-de]-1,4-benzooxazine-6-carboxylic acid
  • BFF-122
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