Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: AG-13958 monohydrate
RN: 865411-27-4
UNII: 15VTU0Z1XL
InChIKey: CEEBKRSSENLBDD-YGCVIUNWSA-N

Molecular Formula

  • C26-H22-F-N7-O.H2-O

Molecular Weight

  • 485.5206
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • AG-13958 monohydrate

Synonyms

  • 1H-Pyrazole-5-carboxamide, N-(2-fluoro-5-((3-((1E)-2-(2-pyridinyl)ethenyl)-1H-indazol-6-yl)amino)phenyl)-1,3-dimethyl-, hydrate (1:1)
  • 1H-Pyrazole-5-carboxamide, N-(2-fluoro-5-((3-((1E)-2-(2-pyridinyl)ethenyl)-1H-indazol-6-yl)amino)phenyl)-1,3-dimethyl-, monohydrate
  • AG-13958 monohydrate
  • N-(2-Fluoro-5-((3-((E)-2-(2-pyridyl)vinyl)-1H-indazol-6-yl)amino)phenyl)-2,5-dimethyl-pyrazole-3-carboxamide, hydrate
  • UNII-15VTU0Z1XL

Registry Numbers

CAS Registry Number

  • 865411-27-4

FDA UNII

  • 15VTU0Z1XL

System Generated Number

  • 0865411274

Structure Descriptors

InChI

1S/C26H22FN7O.H2O/c1-16-13-25(34(2)33-16)26(35)30-24-15-19(7-10-21(24)27)29-18-6-9-20-22(31-32-23(20)14-18)11-8-17-5-3-4-12-28-17;/h3-15,29H,1-2H3,(H,30,35)(H,31,32);1H2/b11-8+;

InChIKey

CEEBKRSSENLBDD-YGCVIUNWSA-N

Smiles

O.Cc1cc(C(=O)Nc2cc(Nc3ccc4c(\C=C\c5ccccn5)n[nH]c4c3)ccc2F)n(C)n1