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Substance Name: Tilapertin dihydrochloride monohydrate
RN: 1392484-48-8
UNII: J38W30OH53
InChIKey: XWTYMLWXSSRROS-RGFWRHHQSA-N

Molecular Formula

  • C20-H21-F3-N2-O2.2Cl-H.H2-O

Molecular Weight

  • 469.3253
 
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Names and Synonyms

Name of Substance

  • Tilapertin dihydrochloride monohydrate

Synonyms

  • 1-Piperazineacetic acid, 4-((R)-phenyl(3-(trifluoromethyl)phenyl)methyl)-, hydrochloride, hydrate (1:2:1)
  • Tilapertin dihydrochloride monohydrate
  • UNII-J38W30OH53

Registry Numbers

CAS Registry Number

  • 1392484-48-8

FDA UNII

  • J38W30OH53

System Generated Number

  • 1392484488

Structure Descriptors

InChI

1S/C20H21F3N2O2.2ClH.H2O/c21-20(22,23)17-8-4-7-16(13-17)19(15-5-2-1-3-6-15)25-11-9-24(10-12-25)14-18(26)27;;;/h1-8,13,19H,9-12,14H2,(H,26,27);2*1H;1H2/t19-;;;/m1.../s1

InChIKey

XWTYMLWXSSRROS-RGFWRHHQSA-N

Smiles

O.Cl.Cl.OC(=O)CN1CCN(CC1)[C@H](c2ccccc2)c3cccc(c3)C(F)(F)F