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Chemical structure of ELOVL6-IN-5

GC75719

ELOVL6-IN-5

Also known as 3-pyridin-2-ylsulfonyl-N-[4-(trifluoromethyl)phenyl]-8-azabicyclo[3.2.1]octane-8-carboxamide

ELOVL6-IN-5 (compound B) is an inhibitor of the elongase enzyme of long-chain fatty acid family 6 (ELOVL6)

ChemicalCAS1135000-36-0MW439.45FormulaC20H20F3N3O3S
CAS number
1135000-36-0
Molecular weight
439.45
Formula
C20H20F3N3O3S
InChIKey
WYCGDOXAJCYGEC-UHFFFAOYSA-N
Catalogue number
GC75719
Brand
GLPBIO
Computed properties PubChem CID 25234001 · XLogP 3.4 · TPSA 87.8 Ų · H-bond donors 1
XLogP
3.4
TPSA
87.8 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
30

SMILES C1CC2CC(CC1N2C(=O)NC3=CC=C(C=C3)C(F)(F)F)S(=O)(=O)C4=CC=CC=N4

Computed descriptors from PubChem (CID 25234001), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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