Chemical Compound

(S)-selisistat

CAS Registry Number848193-68-0
(S)-selisistat chemical structure
Primary record

(S)-selisistat

CAS
848193-68-0
PubChem CID
707029
SMILES
C1C[C@@H](C2=C(C1)C3=C(N2)C=CC(=C3)Cl)C(=O)N
Molecular Formula
C13H13ClN2O
Molecular Weight
248.713
Exact Mass
248.0716
InChI
InChI=1S/C13H13ClN2O/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(15)17)12(8)16-11/h4-6,9,16H,1-3H2,(H2,15,17)/t9-/m0/s1
InChIKey
FUZYTVDVLBBXDL-VIFPVBQESA-N
LogP
2.7265
TPSA
58.88

Names and synonyms

  • (S)-selisistat
  • EX-527 S-enantiomer
  • 848193-68-0
  • Selisistat, (S)-
  • Selisistat S-enantiomer
  • 4bvb
  • MUD9R3TJV3
  • UNII-MUD9R3TJV3
  • C13H13ClN2O
  • AC1LE65R
  • EX-527 (S)-enantiomer
  • EX-527 (S-enantiomer)
  • CHEMBL597477
  • EX527
  • (S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
  • EX-527(S)
  • cc-651
  • (1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-carboxamide
  • EX-527
  • MFCD20503073
  • orb1300104
  • SCHEMBL1870769
  • CHEBI:90371
  • ZINC93985
  • GLXC-10836
  • EX-527 (S)
  • BDBM50309833
  • CID707029
  • EX 527
  • EX-243