Compound Q&A

How is 8-Fluoro-2-{4-[(methylamino)methyl]phenyl}-1,3,4,5-tetrahydro-6H-azepino[5,4,3-cd]indol-6-one phosphate (1:1) (CAS: 459868-92-9) typically synthesized?

Answer

8-Fluoro-2-{4-[(methylamino)methyl]phenyl}-1,3,4,5-tetrahydro-6H-azepino[5,4,3-cd]indol-6-one phosphate (1:1)
The compound can be synthesized via a multi-step process involving the condensation of an azepino[5,4,3-cd]indoline derivative with a substituted aniline in the presence of a base like sodium hydride. The reaction is typically carried out in a solvent such as dimethylformamide (DMF) under reflux conditions. The yield is good, around 70-80%, with high selectivity towards the desired product.

About

English Name 8-Fluoro-2-{4-[(methylamino)methyl]phenyl}-1,3,4,5-tetrahydro-6H-azepino[5,4,3-cd]indol-6-one phosphate (1:1)
Molecular Formula C19H21FN3O5P
Molecular Weight 421.37 g/mol
SMILES CNCc1ccc(cc1)c2c3c4c(cc(cc4[nH]2)F)C(=O)NCC3.OP(=O)(O)O
InChIKey FCCGJTKEKXUBFZ-UHFFFAOYSA-N
Last Updated: 2025-09-08 00:42

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