Dabrafenib-Glu

Product Specifications

Hazard Statement

No Data Available

Smiles

CC(C)(CO[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O)c2nc(c3cccc(NS(=O)(=O)c4c(F)cccc4F)c3F)c(s2)c5ccnc(N)n5

Molecular Formula

C29 H28 F3 N5 O9 S2

Molecular Weight

711.686

InChI

InChI=1S/C29H28F3N5O9S2/c1-29(2,11-45-26-21(40)19(38)20(39)22(46-26)25(41)42)27-36-18(23(47-27)16-9-10-34-28(33)35-16)12-5-3-8-15(17(12)32)37-48(43,44)24-13(30)6-4-7-14(24)31/h3-10,19-22,26,37-40H,11H2,1-2H3,(H,41,42)(H2,33,34,35)/t19-,20-,21+,22-,26+/m0/s1

Additionnal Information

IUPAC name: (2S,3S,4S,5R,6R)-6-[2-[5-(2-aminopyrimidin-4-yl)-4-[3-[(2,6-difluorophenyl)sulfonylamino]-2-fluorophenyl]-1,3-thiazol-2-yl]-2-methylpropoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid