Chemical Compound

Ponatinib Rc 7

CAS Registry Number1300690-48-5
Ponatinib Rc 7 chemical structure
Primary record

Ponatinib Rc 7

CAS
1300690-48-5
PubChem CID
58945624
SMILES
CC1=C(C=C(C=C1)C(=O)O)C#CC2=CN=C3N2N=CC=C3
Molecular Formula
C16H11N3O2
Molecular Weight
277.283
Exact Mass
277.0851
InChI
InChI=1S/C16H11N3O2/c1-11-4-5-13(16(20)21)9-12(11)6-7-14-10-17-15-3-2-8-18-19(14)15/h2-5,8-10H,1H3,(H,20,21)
InChIKey
SCMPXDBRMCTALZ-UHFFFAOYSA-N
LogP
2.1357
TPSA
67.49

Names and synonyms

  • 1300690-48-5
  • Ponatinib Rc 7
  • Ponatinib Impurity 7
  • AP-24600
  • AP24600
  • UNII-OZ477A282R
  • RefChem:199611
  • OZ477A282R
  • MFCD27980055
  • 3-(2-(imidazo[1,2-b]pyridazin-3-yl)ethynyl)-4-methylbenzoic acid
  • 3-(2-{imidazo[1,2-b]pyridazin-3-yl}ethynyl)-4-methylbenzoic acid
  • SCHEMBL589881
  • orb1705050
  • SCHEMBL29506341
  • SCMPXDBRMCTALZ-UHFFFAOYSA-N
  • C16H11N3O2
  • 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic acid
  • ACC69048
  • AMY40099
  • BCP29605
  • NSC804635
  • 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic acid
  • AKOS027251238
  • ZINC114164955
  • HY-W059917
  • NSC-804635
  • SB17753
  • Benzoic acid, 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-
  • AS-52045
  • DA-12847