Chemical Compound

4-(2-{4-[(2S)-6-bromo-13-chloro-15-fluoro-4-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-2-yl]piperazin-1-yl}-2-oxoethyl)-1-oxidopyridin-1-ium

4-(2-{4-[(2S)-6-bromo-13-chloro-15-fluoro-4-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-2-yl]piperazin-1-yl}-2-oxoethyl)-1-oxidopyridin-1-ium 结构式
Primary record

4-(2-{4-[(2S)-6-bromo-13-chloro-15-fluoro-4-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-2-yl]piperazin-1-yl}-2-oxoethyl)-1-oxidopyridin-1-ium

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
10674120
SMILES
C1CC2=C([C@H](C3=C1C=C(C=C3F)Cl)N4CCN(CC4)C(=O)CC5=CC=[N+](C=C5)[O-])N=CC(=C2)Br
Canonical SMILES
O=C(Cc1cc[n+]([O-])cc1)N1CCN([C@@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(F)c32)CC1

名称与同义词

  • CHEMBL142724
  • BDBM14466
  • CID 9915408
  • CID10674120
  • J1.042.502F
  • Trihalobenzocycloheptapyridine Tricyclic Compound 38
  • (-)-4-(3-Bromo-8-chloro-10-fluoro-6,11-dihydro-5H-benzo-[5,6]cyclohepta[1,2-b]pyridin-11(S)-yl)-4-(4-pyridinylacetyl)-piperazine N4-Oxide
  • 4-(2-{4-[(2S)-6-bromo-13-chloro-15-fluoro-4-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-2-yl]piperazin-1-yl}-2-oxoethyl)-1-oxidopyridin-1-ium
  • 4-(2-{4-[(2S)-6-bromo-13-chloro-15-fluoro-4-azatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl]piperazin-1-yl}-2-oxoethyl)pyridin-1-ium-1-olate
  • 4-[2-[4-[[(S)-3-Bromo-8-chloro-10-fluoro-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine]-11alpha-yl]-1-piperazinyl]-2-oxoethyl]pyridine 1-oxide