New synthesis of a late-stage tetracyclic key intermediate of lumateperone

Mátyás Milen, Bálint Nyulasi, Tamás Nagy, Gyula Simig and Balázs Volk
Beilstein J. Org. Chem. 2022, 18, 653–659. https://doi.org/10.3762/bjoc.18.66

Chemical Information

Calculated using the Chemistry Development Kit 2.12
Molecular Formula C10H10ClFO
Molecular Weight 200.64 g/mol
Exact Mass 200.0404 Da
InChI
InChI=1S/C10H10ClFO/c11-7-1-2-10(13)8-3-5-9(12)6-4-8/h3-6H,1-2,7H2
InChIKey
HXAOUYGZEOZTJO-UHFFFAOYSA-N
SMILES
C(CC(=O)C1=CC=C(C=C1)F)CCl
Number of Atoms 23
Number of H-Bond Acceptors 1
Number of H-Bond Donors 0
Atoms in the Largest π-System 8
XLogP 1.7
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