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Chemical structure of GSK2256294A (GSK 2256294)

GC32455

GSK2256294A (GSK 2256294)

Also known as cis-(1R,3S)-N-[[4-cyano-2-(trifluoromethyl)phenyl]methyl]-3-[[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]amino]cyclohexane-1-carboxamide

GSK2256294A (GSK 2256294) (GSK 2256294) is a selective and orally active inhibitor of soluble epoxide hydrolase (sEH)

ChemicalCAS1142090-23-0MW447.46FormulaC21H24F3N7O
CAS number
1142090-23-0
Molecular weight
447.46
Formula
C21H24F3N7O
Solubility
DMSO ： ≥ 47 mg/mL (105·04 mM)
InChIKey
LQHDJQIMETZMPH-ZBFHGGJFSA-N
Catalogue number
GC32455
Brand
GLPBIO
Computed properties PubChem CID 59448236 · XLogP 3.7 · TPSA 116 Ų · H-bond donors 3
XLogP
3.7
TPSA
116 Ų
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
6
Heavy atoms
32

SMILES CC1=NC(=NC(=N1)N[C@H]2CCC[C@H](C2)C(=O)NCC3=C(C=C(C=C3)C#N)C(F)(F)F)NC

Computed descriptors from PubChem (CID 59448236), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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