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Lumateperone (Tosylate)

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Lumateperone (Tosylate) / CAS : 1187020-80-9

Appearance White to gray solid UN 0
HS 29420000 DG Class 0
Synonyms ITI-007; ITI-722; 4-((6bR,10aS)-3-Methyl-2,3,6b,9,10,10a-Hexahydro-1H-Pyrido[3′,4′:4,5]Pyrrolo[1,2,3-de]Quinoxalin-8(7H)-yl)-1-(4-Fluorophenyl)-1-Butanone Tosylate; 1-(4-Fluorophenyl)-4-[(6bR,10aS)-3-Methyl-2,3,6b,7,8,9,10,10a-Octahydro-1H-Pyrido[3',4':4,5]Pyrrolo[1,2,3-de]Quinoxalin-8-yl]Butan-1-one Tosylate; 4-((6bR,10aS)-3-Methyl-2,3,6b,9,10,10a-Hexahydro-1H,7H-Pyrido[3',4':4,5]Pyrrolo[1,2,3-de]Quinoxalin-8-yl)-1-(4-Fluorophenyl)Butan-1-one 4-Methylbenzenesulfonate
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Properties

Summary

Formula
C31H36FN3O4S
Molecular Mass
565.6986432
Exact Mass
565.24100
PSA
89.54000
Logp
6.30690
IUPAC
1-(4-fluorophenyl)-4-[(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]butan-1-one;4-methylbenzenesulfonic acid
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

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Appearance
White to gray solid

Export information

HS Code
29420000
Export Rebate
13%
UN No.
0
DG-Class
0

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