Chemical Compound

Biricodar

CAS Registry Number159997-94-1
Biricodar chemical structure
Primary record

Biricodar

CAS
159997-94-1
PubChem CID
3037617
SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)C(=O)N2CCCC[C@H]2C(=O)OC(CCCC3=CN=CC=C3)CCCC4=CN=CC=C4
Molecular Formula
C34H41N3O7
Molecular Weight
603.716
Exact Mass
603.2945
InChI
InChI=1S/C34H41N3O7/c1-41-29-20-26(21-30(42-2)32(29)43-3)31(38)33(39)37-19-5-4-16-28(37)34(40)44-27(14-6-10-24-12-8-17-35-22-24)15-7-11-25-13-9-18-36-23-25/h8-9,12-13,17-18,20-23,27-28H,4-7,10-11,14-16,19H2,1-3H3/t28-/m0/s1
InChIKey
CGVWPQOFHSAKRR-NDEPHWFRSA-N
LogP
5.0238
TPSA
117.15

Names and synonyms

  • Biricodar
  • Incel
  • Biricodar [INN]
  • biricodarum
  • 159997-94-1
  • Incel (TN)
  • 3KG76X4KJK
  • UNII-3KG76X4KJK
  • BIRICODAR [MI]
  • Vx 710
  • RefChem:119979
  • VX-710
  • D02VJY
  • AC1MI37E
  • BIRICODAR [WHO-DD]
  • CHEMBL350775
  • SCHEMBL154547
  • DTXSID50893944
  • orb1707546
  • SCHEMBL29405867
  • GTPL11741
  • CHEBI:135847
  • DTXCID501324010
  • GLXC-05038
  • VX710
  • Pyridine,2-(chloromethyl)-4-ethoxy
  • BDBM50109811
  • C3441N3O7
  • EX-A14888
  • HY-13574A