Chem
J-GLOBAL ID：201407070010900962   Nikkaji number：J3.264.181D

AZD-4547

AZD-4547
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： C26H33N5O3
Molecular formula furigana： C26-H33-N5-O3
Molecular weight： 463.582
InChI： InChI=1S/C26H33N5O3/c1-17-15-31(16-18(2)27-17)22-9-6-20(7-10-22)26(32)28-25-13-21(29-30-25)8-5-19-11-23(33-3)14-24(12-19)34-4/h6-7,9-14,17-18,27H,5,8,15-16H2,1-4H3,(H2,28,29,30,32)/t17-,18+
InChI key： VRQMAABPASPXMW-HDICACEKSA-N
SMILES： COc1cc(CCc2cc(NC(=O)c3ccc(cc3)N3C[C@H](C)N[C@H](C)C3)[nH]n2)cc(OC)c1
Systematic name  (4)：
  • N-[3-(3,5-ジメトキシフェネチル)-1H-ピラゾール-5-イル]-4-(3α,5α-ジメチル-1-ピペラジニル)ベンズアミド
  • N-[3-(3,5-ジメトキシフェネチル)-1H-ピラゾール-5-イル]-4-[(3S,5R)-3,5-ジメチル-1-ピペラジニル]ベンズアミド
  • N-{3-[2-(3,5-ジメトキシフェニル)エチル]-1H-ピラゾール-5-イル}-4-[(3R,5S)-3,5-ジメチルピペラジン-1-イル]ベンズアミド
  • N-{3-[2-(3,5-dimethoxyphenyl)ethyl]-1H-pyrazol-5-yl}-4-[(3R,5S)-3,5-dimethylpiperazin-1-yl]benzamide
Other name (3)：
  • N-[3-(3,5-Dimethoxyphenethyl)-1H-pyrazole-5-yl]-4-(3α,5α-dimethyl-1-piperazinyl)benzamide
  • AZD-4547
  • N-[3-(3,5-Dimethoxyphenethyl)-1H-pyrazole-5-yl]-4-[(3S,5R)-3,5-dimethyl-1-piperazinyl]benzamide
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