Chemical Compound

Unesbulin

CAS Registry Number1610964-64-1
Unesbulin chemical structure
Primary record

Unesbulin

CAS
1610964-64-1
PubChem CID
74223469
SMILES
CC1=NC2=C(N1C3=NC(=C(C(=N3)NC4=CC=C(C=C4)C(F)(F)F)F)N)C=C(C=C2)F
Molecular Formula
C19H13F5N6
Molecular Weight
420.345
Exact Mass
420.1122
InChI
InChI=1S/C19H13F5N6/c1-9-26-13-7-4-11(20)8-14(13)30(9)18-28-16(25)15(21)17(29-18)27-12-5-2-10(3-6-12)19(22,23)24/h2-8H,1H3,(H3,25,27,28,29)
InChIKey
TWLWOOPCEXYVBE-UHFFFAOYSA-N
LogP
4.7467
TPSA
81.65

Names and synonyms

  • Unesbulin
  • PTC596
  • 1610964-64-1
  • Unesbulin [USAN]
  • Unesblin (USAN)
  • BMI1 inhibitor PTC596
  • PTC-596
  • UNESBULIN [INN]
  • Unesbulin (PTC596)
  • RefChem:193123
  • Z4HZ70S62Q
  • PTC 596
  • UNESBULIN [WHO-DD]
  • UNII-Z4HZ70S62Q
  • C19H13F5N6
  • orb1309210
  • CHEMBL4594353
  • SCHEMBL15741319
  • SCHEMBL29377707
  • SCHEMBL29471411
  • SCHEMBL30544391
  • PTC596?
  • TWLWOOPCEXYVBE-UHFFFAOYSA-N
  • 5-Fluoro-2-(6-fluoro-2-methyl-1H-benzo[d]imidazol-1-yl)-N4-(4-(trifluoromethyl)phenyl)pyrimidine-4,6-diamine
  • BCP33231
  • EX-A3263
  • KPC96464
  • PTC-596; PTC 596
  • s8820
  • WHO 11570