Chemical Compound

lumateperone Tosylate

CAS Registry Number1187020-80-9
lumateperone Tosylate chemical structure
Primary record

lumateperone Tosylate

CAS
1187020-80-9
PubChem CID
44241743
SMILES
CC1=CC=C(C=C1)S(=O)(=O)O.CN1CCN2[C@H]3CCN(C[C@H]3C4=C2C1=CC=C4)CCCC(=O)C5=CC=C(C=C5)F
Molecular Formula
C31H36FN3O4S
Molecular Weight
565.711
Exact Mass
565.2411
InChI
InChI=1S/C24H28FN3O.C7H8O3S/c1-26-14-15-28-21-11-13-27(16-20(21)19-4-2-5-22(26)24(19)28)12-3-6-23(29)17-7-9-18(25)10-8-17;1-6-2-4-7(5-3-6)11(8,9)10/h2,4-5,7-10,20-21H,3,6,11-16H2,1H3;2-5H,1H3,(H,8,9,10)/t20-,21-;/m0./s1
InChIKey
LHAPOGAFBLSJJQ-GUTACTQSSA-N
LogP
5.1582
TPSA
81.16

Names and synonyms

  • lumateperone Tosylate
  • lumateperone (Tosylate)
  • Caplyta
  • ITI-007 tosylate
  • 1187020-80-9
  • Caplyta (TN)
  • lumateperone TosylateI
  • lumateperone Tosylate?
  • RefChem:57790
  • Lumateperone(iti-007)
  • JIE88N006O
  • UNII-JIE88N006O
  • Lumateperone Tosylate Salt
  • Lumateperone tosylate [USAN]
  • ITI 007
  • ITI-007
  • ITI007
  • Lumateperone tosylate (USAN)
  • C31H36FN3O4S
  • DTXSID701026210
  • SCHEMBL1769664
  • CHEMBL3233142
  • SCHEMBL29355976
  • LHAPOGAFBLSJJQ-GUTACTQSSA-N
  • MFCD29922434
  • DTXCID101510463
  • GLXC-10824
  • EBC-90131
  • LUMATEPERONE TOSYLATE [WHO-DD]
  • CS-5540