EG7

(2R,4R)-1-[(3-chloro-2-fluorophenyl)methyl]-4-({3-fluoro-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridin-2-yl}methyl)-2-methylpiperidine-4-carboxylic acid


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Chemical Component Summary

Name(2R,4R)-1-[(3-chloro-2-fluorophenyl)methyl]-4-({3-fluoro-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridin-2-yl}methyl)-2-methylpiperidine-4-carboxylic acid
Identifiers(2~{R},4~{R})-1-[(3-chloranyl-2-fluoranyl-phenyl)methyl]-4-[[3-fluoranyl-6-[(5-methyl-1~{H}-pyrazol-3-yl)amino]pyridin-2-yl]methyl]-2-methyl-piperidine-4-carboxylic acid
FormulaC24 H26 Cl F2 N5 O2
Molecular Weight489.945
TypeNON-POLYMER
Isomeric SMILESCc1cc(n[nH]1)Nc2ccc(c(n2)C[C@]3(CCN([C@@H](C3)C)Cc4cccc(c4F)Cl)C(=O)O)F
InChIInChI=1S/C24H26ClF2N5O2/c1-14-10-21(31-30-14)29-20-7-6-18(26)19(28-20)12-24(23(33)34)8-9-32(15(2)11-24)13-16-4-3-5-17(25)22(16)27/h3-7,10,15H,8-9,11-13H2,1-2H3,(H,33,34)(H2,28,29,30,31)/t15-,24-/m1/s1
InChIKeyYQQZZYYQTCPEAS-OYLFLEFRSA-N

Chemical Details

Formal Charge0
Atom Count60
Chiral Atom Count2
Bond Count63
Aromatic Bond Count17

Drug Info: DrugBank

DrugBank IDDB18019 
NameLY3295668
Groups investigational
Synonyms
  • LY3295668 Erbumine
  • LY3295668
  • 1-((3-chloro-2-fluorophenyl)methyl)-4-((3-fluoro-6-((5-methyl-1h-pyrazol-3-yl)amino)-2-pyridinyl)methyl)-2-methyl-, (2r,4r)-,4-piperidinecarboxylic acid
  • 4-piperidinecarboxylic acid, 1-((3-chloro-2-fluorophenyl)methyl)-4-((3-fluoro-6-((5-methyl-1h-pyrazol-3-yl)amino)-2-pyridinyl)methyl)-2-methyl-, (2r,4r)-
  • Aurora a kinase inhibitor ly3295668
CAS number1919888-06-4

Related Resource References

Resource NameReference
PubChem 121333423