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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2427374Generated: October 25, 2026

2,6-Dichlorobenzothiazole → 4-{4'-[(6-Chloro-1,3-benzothiazol-2-yl)amino]-1,1'-biphenyl-4-yl}-4-oxo-2-(2-phenylethyl)butanoic acid

https://huagongshe.com/reaction/2427374

Reaction equation

Participants

RoleNameHCIDCharge
Reactant2,6-DichlorobenzothiazoleHCID 77176—
Reactant4-[4'-(1,3-Benzothiazol-2-ylamino)-1,1'-biphenyl-4-yl]-2,2-dimethyl-4-oxobutanoic acidHCID 11475930—
ReactantMethyl 4-(4'-amino-1,1'-biphenyl-4-yl)-4-oxo-2-(2-phenylethyl)butanoateHCID 21985736—
Product4-{4'-[(6-Chloro-1,3-benzothiazol-2-yl)amino]-1,1'-biphenyl-4-yl}-4-oxo-2-(2-phenylethyl)butanoic acidHCID 1149755325%

Reaction Steps

This compound was prepared from methyl 4-(4′-amino-1,1′-biphenyl-4-yl)-4-oxo-2-(2-phenylethyl)butanoate (78 mg, 0.20 mmol), 2,6-dichloro-1,3-benzothiazole (61.6 mg, 0.30 mmol) in a similar manner to the method described for 4-[4′-(1,3-benzothiazol-2-ylamino)-1,1′-biphenyl-4-yl]-2,2-dimethyl-4-oxobutanoic acid, providing 26.7 mg (25%) of the desired product. 1H NMR (400 MHz, DMSO-d6) δ 10.80 (br s, 1 H), 7.75-8.05 (m, 9 H), 7.60 (d, 1 H), 7.10-7.40 (m, 6 H), 3.50 (q, 1 H), 3.10 (m, 1 H), 2.85 (m, 1 H), 2.65 (m, 2 H), 1.80 (m, 2 H). LC-MS m/z 541.3 (MH+), ret. time 4.07 min.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07968576B2
Source datasetuspto-grants-2011_06
ORD IDord-8a8d0f4d06db45b1b4de0d9d0f6dda3f
Source noteuspto-grants-2011_06