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Chemical structure of Cobimetinib hemifumarate

GC35719

Cobimetinib hemifumarate

Also known as (E)-but-2-enedioic acid;[3,4-difluoro-2-(2-fluoro-4-iodoanilino)phenyl]-[3-hydroxy-3-[(2S)-piperidin-2-yl]azetidin-1-yl]methanone

Cobimetinib hemifumarate is a novel selective MEK1 inhibitor, and the IC50 value against MEK1 is 4·2 nM

ChemicalCAS1369665-02-0MW647.38FormulaC25H25F3IN3O6
CAS number
1369665-02-0
Molecular weight
647.38
Formula
C25H25F3IN3O6
Solubility
DMSO： 50 mg/mL (77·23 mM)
InChIKey
CBHDLXWLRMYMNL-QTNVCCTOSA-N
Catalogue number
GC35719
Brand
GLPBIO
Computed properties PubChem CID 71301366 · TPSA 139 Ų · H-bond donors 5 · H-bond acceptors 11
TPSA
139 Ų
H-bond donors
5
H-bond acceptors
11
Rotatable bonds
6
Heavy atoms
38

SMILES C1CCN[C@@H](C1)C2(CN(C2)C(=O)C3=C(C(=C(C=C3)F)F)NC4=C(C=C(C=C4)I)F)O.C(=C/C(=O)O)\C(=O)O

Computed descriptors from PubChem (CID 71301366), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
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