Chemical Compound

Acolbifene

CAS Registry Number182167-02-8
Acolbifene chemical structure
Primary record

Acolbifene

CAS
182167-02-8
PubChem CID
155435
SMILES
CC1=C([C@@H](OC2=C1C=CC(=C2)O)C3=CC=C(C=C3)OCCN4CCCCC4)C5=CC=C(C=C5)O
Molecular Formula
C29H31NO4
Molecular Weight
457.57
Exact Mass
457.2253
InChI
InChI=1S/C29H31NO4/c1-20-26-14-11-24(32)19-27(26)34-29(28(20)21-5-9-23(31)10-6-21)22-7-12-25(13-8-22)33-18-17-30-15-3-2-4-16-30/h5-14,19,29,31-32H,2-4,15-18H2,1H3/t29-/m0/s1
InChIKey
DUYNJNWVGIWJRI-LJAQVGFWSA-N
LogP
6.0269
TPSA
62.16

Names and synonyms

  • Acolbifene
  • acolbifeno
  • rac-Acolbifene
  • (Rac)-Acolbifene
  • 182167-02-8
  • EM-652
  • ACOLBIFENUM
  • Acolbifene [INN:BAN]
  • Acolbifene Hydrochloride
  • EM 652.Hydrochloride
  • AC1L4EAA
  • ACOLBIFENE [INN]
  • RefChem:109291
  • SCH 57068
  • SCH-57068
  • SCH57068 Hydrochloride
  • D0XB0T
  • UNII-KXC7811DBY
  • UNII-815LJ9X0D1
  • 815LJ9X0D1
  • ACOLBIFENE (hydrochloride)
  • SCH57068
  • SCH57068.HCl
  • CHEMBL68055
  • SCHEMBL406183
  • DTXSID501318411
  • orb1310023
  • SCHEMBL29351361
  • Acolbifene Hydrochloride [USAN]
  • C29H31NO4