Catalog Number:
AG01CBDB
Chemical Name:
GDC-0941 dimethanesulfonate
CAS Number:
957054-33-0
Molecular Formula:
C25H35N7O9S4
Molecular Weight:
705.8469
MDL Number:
MFCD12546329
IUPAC Name:
4-[2-(1H-indazol-4-yl)-6-[(4-methylsulfonylpiperazin-1-yl)methyl]thieno[3,2-d]pyrimidin-4-yl]morpholine;methanesulfonic acid
InChI:
InChI=1S/C23H27N7O3S2.2CH4O3S/c1-35(31,32)30-7-5-28(6-8-30)15-16-13-20-21(34-16)23(29-9-11-33-12-10-29)26-22(25-20)17-3-2-4-19-18(17)14-24-27-19;2*1-5(2,3)4/h2-4,13-14H,5-12,15H2,1H3,(H,24,27);2*1H3,(H,2,3,4)
InChI Key:
RFRIKACSFOTIMU-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)N1CCN(CC1)Cc1cc2c(s1)c(nc(n2)c1cccc2c1cn[nH]2)N1CCOCC1.CS(=O)(=O)O.CS(=O)(=O)O
UNII:
G3D7HF2GS9
