Chem
J-GLOBAL ID：201707012529707631   Nikkaji number：J3.663.585A

Avacopan

アバコパン
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： C33H35F4N3O2
Molecular formula furigana： C33-H35-F4-N3-O2
Molecular weight： 581.656
InChI： InChI=1S/C33H35F4N3O2/c1-20-12-15-25(19-27(20)33(35,36)37)39-31(41)26-10-6-18-40(32(42)29-21(2)7-5-11-28(29)34)30(26)22-13-16-24(17-14-22)38-23-8-3-4-9-23/h5,7,11-17,19,23,26,30,38H,3-4,6,8-10,18H2,1-2H3,(H,39,41)/t26-,30-/m0/s1
InChI key： PUKBOVABABRILL-YZNIXAGQSA-N
SMILES： Cc1ccc(NC(=O)[C@H]2CCCN([C@H]2c2ccc(NC3CCCC3)cc2)C(=O)c2c(C)cccc2F)cc1C(F)(F)F
Systematic name  (3)：
  • 2β-[4-(シクロペンチルアミノ)フェニル]-1-(2-フルオロ-6-メチルベンゾイル)N-[4-メチル-3-(トリフルオロメチル)フェニル]ピペリジン-3β-カルボキサミド
  • (2R,3S)-2-[4-(シクロペンチルアミノ)フェニル]-1-(2-フルオロ-6-メチルベンゾイル)-N-[4-メチル-3-(トリフルオロメチル)フェニル]ピペリジン-3-カルボキサミド
  • (2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide
Other name (3)：
  • 2β-[4-(Cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3β-carboxamide
  • アバコパン
  • Avacopan
Application (5)：
metabolic drug ,  vasoactive drug ,  ANCA ,  vasculitis ,  Granulomatosis with Polyangiitis
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