Sorafenib Hemi-Tosylate Monohydrate

CAT No.

ALN-S012020

CAS No.

1908433-49-7

Mol. F.

C21H16ClF3N4O3 : 1/2(C7H8O3S) : H2O

Mol. Wt.

464.8 : 1/2(172.2) : 18.0

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Product Overview

Technical Data

Reference

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Product Overview

Chemical Name : 4-[4-[[[4-Chloro-3-(trifluoromethyl)phenyl]carbamoyl]amino]phenoxy]-N-methylpyridine-2-carboxamide hemitosylate monohydrate(as per EP);4-(4-{3-[4-Chloro-3-(trifluoromethyl)phenyl]ureido}phenoxy)-N2-methylpyridine-2-carboxamide hemitosylate monohydrate (as per USP)

Smiles : CNC(C1=CC(OC2=CC=C(NC(NC3=CC=C(Cl)C(C(F)(F)F)=C3)=O)C=C2)=CC=N1)=O.O=[S](O)(C(C=C4)=CC=C4C)=O.O

Inchi : InChI=1S/C21H16ClF3N4O3.BrH/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25;/h2-11H,1H3,(H,26,30)(H2,28,29,31);1H

Technical Data

Reference

By Yu, Dandan; Liang, XianruinFrom Journal of Mass Spectrometry (2018), 53(7), 579-589.

By Wanii, Tanveer A.; Alanazi, Amer M.; Zargar, Seema; Ahmad, Ajaz; Drawish, Ibrahim A. – From Journal of Computational and Theoretical Nanoscience (2015), 12(10), 3598-3604

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