Chemical Compound

Elacestrant

CAS Registry Number722533-56-4
Elacestrant chemical structure
Primary record

Elacestrant

CAS
722533-56-4
PubChem CID
23642301
SMILES
CCNCCC1=CC=C(C=C1)CN(CC)C2=C(C=CC(=C2)OC)[C@@H]3CCC4=C(C3)C=CC(=C4)O
Molecular Formula
C30H38N2O2
Molecular Weight
458.646
Exact Mass
458.2933
InChI
InChI=1S/C30H38N2O2/c1-4-31-17-16-22-6-8-23(9-7-22)21-32(5-2)30-20-28(34-3)14-15-29(30)26-11-10-25-19-27(33)13-12-24(25)18-26/h6-9,12-15,19-20,26,31,33H,4-5,10-11,16-18,21H2,1-3H3/t26-/m1/s1
InChIKey
SIFNOOUKXBRGGB-AREMUKBSSA-N
LogP
5.8518
TPSA
44.73

Names and synonyms

  • Elacestrant
  • elacestrantum
  • RAD1901
  • 722533-56-4
  • ORSERDU
  • Elacestrant [INN]
  • Elacestrant [USAN]
  • RAD-1901
  • RefChem:57007
  • Elacestrant (USAN/INN)
  • Elacestrant [USAN:INN]
  • Elacestrant dihydrochloride
  • FM6A2627A8
  • ELACESTRANT [WHO-DD]
  • SERD/SERM RAD1901
  • ER-306323
  • SCHEMBL229431
  • UNII-FM6A2627A8
  • MFCD30532693
  • DTXSID901045846
  • orb1308827
  • CHEMBL4297509
  • SCHEMBL29359701
  • GTPL12339
  • CHEBI:229213
  • BDBM349630
  • C30H38N2O2
  • DTXCID401527776
  • GLXC-26208
  • EX-A5070