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Substance Name: Infigratinib monohydrate
RN: 1310746-11-2
UNII: 18Y3W0780L
InChIKey: HAHRMIYGWQQRHI-UHFFFAOYSA-N

Molecular Formula

  • C26-H31-Cl2-N7-O3.H2-O

Molecular Weight

  • 578.4977
 
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Names and Synonyms

Name of Substance

  • Infigratinib monohydrate

Synonyms

  • BGJ-398 monohydrate
  • Infigratinib monohydrate
  • UNII-18Y3W0780L
  • Urea, N'-(2,6-dichloro-3,5-dimethoxyphenyl)-N-(6-((4-(4-ethyl-1-piperazinyl)phenyl)amino)-4-pyrimidinyl)-N-methyl-, hydrate (1:1)

Registry Numbers

CAS Registry Number

  • 1310746-11-2

FDA UNII

  • 18Y3W0780L

System Generated Number

  • 1310746112

Structure Descriptors

InChI

1S/C26H31Cl2N7O3.H2O/c1-5-34-10-12-35(13-11-34)18-8-6-17(7-9-18)31-21-15-22(30-16-29-21)33(2)26(36)32-25-23(27)19(37-3)14-20(38-4)24(25)28;/h6-9,14-16H,5,10-13H2,1-4H3,(H,32,36)(H,29,30,31);1H2

InChIKey

HAHRMIYGWQQRHI-UHFFFAOYSA-N

Smiles

CCN1CCN(CC1)c2ccc(cc2)Nc3cc(ncn3)N(C)C(=O)Nc4c(c(cc(c4Cl)OC)OC)Cl.O