Chemical Compound

N-[(2S)-1-[(2S,4R)-4-hydroxy-2-({[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}carbamoyl)pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-N'-[2-(4-{[4'-(4-methylpiperazin-1-yl)-3'-[6-oxo-4-(trifluoromethyl)-1,6-dihydropyridine-3-amido]-[1,1'-biphenyl]-3-yl]methyl}piperazin-1-yl)ethyl]undecanediamide

CAS Registry Number 2407449-11-8
N-[(2S)-1-[(2S,4R)-4-hydroxy-2-({[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}carbamoyl)pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-N'-[2-(4-{[4'-(4-methylpiperazin-1-yl)-3'-[6-oxo-4-(trifluoromethyl)-1,6-dihydropyridine-3-amido]-[1,1'-biphenyl]-3-yl]methyl}piperazin-1-yl)ethyl]undecanediamide 结构式
Primary record

N-[(2S)-1-[(2S,4R)-4-hydroxy-2-({[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}carbamoyl)pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-N'-[2-(4-{[4'-(4-methylpiperazin-1-yl)-3'-[6-oxo-4-(trifluoromethyl)-1,6-dihydropyridine-3-amido]-[1,1'-biphenyl]-3-yl]methyl}piperazin-1-yl)ethyl]undecanediamide

库存
6,523 克
纯度
99.6 %
CAS
2407449-11-8

化合物标识与属性

CAS
2407449-11-8
PubChem CID
153380128
SMILES
CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)CCCCCCCCCC(=O)NCCN4CCN(CC4)CC5=CC(=CC=C5)C6=CC(=C(C=C6)N7CCN(CC7)C)NC(=O)C8=CNC(=O)C=C8C(F)(F)F)O
Canonical SMILES
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCCCC(=O)NCCN2CCN(Cc3cccc(-c4ccc(N5CCN(C)CC5)c(NC(=O)c5c[nH]c(=O)cc5C(F)(F)F)c4)c3)CC2)C(C)(C)C)cc1

名称与同义词

  • MS33
  • Protac MS33
  • WDR5 degrader MS169
  • orb1690924
  • SCHEMBL23270877
  • SCHEMBL29921202
  • GLXC-25903
  • GLXC-27858
  • MS169
  • AKOS040757655
  • DA-65685
  • HY-141797
  • CS-0213516
  • 2407449-11-8
  • EN300-44825995
  • N1-((S)-1-((2S,4R)-4-Hydroxy-2-((4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)-N11-(2-(4-((4'-(4-methylpiperazin-1-yl)-3'-(6-oxo-4-(trifluoromethyl)-1,6-dihydropyridine-3-carboxamido)-[1,1'-biphenyl]-3-yl)methyl)piperazin-1-yl)ethyl)undecanediamide
  • 3-methyl-N-(11-{[2-(4-{[4'-(4-methylpiperazin-1-yl)-3'-{[6-oxo-4-(trifluoromethyl)-5,6-dihydropyridine-3-carbonyl]amino}[1,1'-biphenyl]-3-yl]methyl}piperazin-1-yl)ethyl]amino}-11-oxoundecanoyl)-L-valyl-(4R)-4-hydroxy-N-{[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}-L-prolinamide
  • N'-[(2S)-1-[(2S,4R)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-N-[2-[4-[[3-[4-(4-methylpiperazin-1-yl)-3-[[6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carbonyl]amino]phenyl]phenyl]methyl]piperazin-1-yl]ethyl]undecanediamide
  • N-[(2S)-1-[(2S,4R)-4-hydroxy-2-({[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}carbamoyl)pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]-N'-[2-(4-{[4'-(4-methylpiperazin-1-yl)-3'-[6-oxo-4-(trifluoromethyl)-1,6-dihydropyridine-3-amido]-[1,1'-biphenyl]-3-yl]methyl}piperazin-1-yl)ethyl]undecanediamide
  • VKA