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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1370945Generated: October 26, 2026

beta-Alanine, ethyl ester, hydrochloride → N-[5-(4-{4-[(benzyl{2-methyl-3-[(methylsulfonyl)amino]phenyl}amino)methyl]phenoxy}phenoxy)pentanoyl]-beta-alanine

https://huagongshe.com/reaction/1370945

Reaction equation

Participants

RoleNameHCIDCharge
Reactantbeta-Alanine, ethyl ester, hydrochlorideHCID 458475—
Reactant5-(4-{4-[(benzyl{2-methyl-3-[(methylsulfonyl)amino]phenyl}amino)methyl]phenoxy}phenoxy)pentanoic AcidHCID 18512225—
ProductN-[5-(4-{4-[(benzyl{2-methyl-3-[(methylsulfonyl)amino]phenyl}amino)methyl]phenoxy}phenoxy)pentanoyl]-beta-alanineHCID 18512177—

Reaction Steps

The product from Example 234B and beta-alanine ethyl ester hydrochloride were processed as described in Example 251A and B to provide the titled compound. 1H NMR (500 MHz, DMSO-d6) δ11.84-12.51 (br.s, 1 H), 8.94 (s, 1 H), 7.85 (t, 1 H), 7.22 (m, 7 H), 7.03 (t, J=7.8 Hz, 1 H), 6.94 (m, 6 H), 6.82 (d, 2 H), 4.04 (s, 2 H), 4.00 (s, 2 H), 3.92 (t, 2 H), 3.23 (dd, 2 H), 2.91 (s, 3 H), 2.39 (s, 3 H), 2.36 (t, 2 H), 2.11 (t, 2 H), 1.64 (m, 4 H); MS (ESI+) m/z 660 (M+H)+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06583180B2
Source datasetuspto-grants-2003_06
ORD IDord-19d14b479b9f4acf9537be7692830df8
Source noteuspto-grants-2003_06