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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 541975Generated: October 25, 2026

4-Fluorophenyl isocyanate → (3S)-3-(2-{[6-Chloro-2,4,8,18,22-pentaazatetracyclo[14.3.1.1(3,7).1(9,13)]docosa-1(20),3(22),4,6,9(21),10,12,16,18-nonaen-12-yl]amino}-2-oxoethyl)-N-(4-fluorophenyl)pyrrolidine-1-carboxamide bis(trifluoroacetate)

https://huagongshe.com/reaction/541975

Reaction equation

Participants

RoleNameHCIDCharge
Reactant4-Fluorophenyl isocyanateHCID 70955—
ReactantN-[6-chloro-2,4,8,18,22-pentaazatetracyclo[14.3.1.1(3,7).1(9,13)]docosa-1(20),3(22),4,6,9(21),10,12,16,18-nonaen-12-yl]-2-[(3S)-pyrrolidin-3-yl]acetamide tris(trifluoroacetate)HCID 86636313—
Product(3S)-3-(2-{[6-Chloro-2,4,8,18,22-pentaazatetracyclo[14.3.1.1(3,7).1(9,13)]docosa-1(20),3(22),4,6,9(21),10,12,16,18-nonaen-12-yl]amino}-2-oxoethyl)-N-(4-fluorophenyl)pyrrolidine-1-carboxamide bis(trifluoroacetate)HCID 8663631879%

Reaction Steps

The desired compound was prepared according to the procedure of Example D41 using N-[6-chloro-2,4,8,18,22-pentaazatetracyclo[14.3.1.1(3,7).1(9,13)]docosa-1(20),3(22),4,6,9(21),10,12,16,18-nonaen-12-yl]-2-[(3S)-pyrrolidin-3-yl]acetamide tris(trifluoroacetate) and 1-fluoro-4-isocyanatobenzene as the starting materials in 79% yield. LCMS for C30H29ClFN8O2 (M+H)+: m/z=587.0.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08871753B2
Source datasetuspto-grants-2014_10
ORD IDord-bcb36315fe2f46c08d115861ac3f2409
Source noteuspto-grants-2014_10