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Chemical structure of Nav1·1 activator 1

GC61110

Nav1·1 activator 1

Also known as 4-(2,5-difluorophenyl)-2-[(3S)-3-fluoropyrrolidin-1-yl]-N-(6-propan-2-yl-3-pyridinyl)pyridine-3-carboxamide

Nav1·1 activator 1 (compound 4), a highly potent Nav1·1 activator with BBB penetration, increases decay time constant (tau) of Nav1·1 currents at 0·03 μM along with significant selectivity against Nav1·2, Nav1·5, and Nav1·6

ChemicalCAS2332897-85-3MW440.46FormulaC24H23F3N4O
CAS number
2332897-85-3
Molecular weight
440.46
Formula
C24H23F3N4O
Solubility
DMSO ： 250 mg/mL (567·59 mM; Need ultrasonic)
InChIKey
HRGJTEFGFUJXIF-INIZCTEOSA-N
Catalogue number
GC61110
Brand
GLPBIO
Computed properties PubChem CID 146014435 · XLogP 4.6 · TPSA 58.1 Ų · H-bond donors 1
XLogP
4.6
TPSA
58.1 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
32

SMILES CC(C)C1=NC=C(C=C1)NC(=O)C2=C(C=CN=C2N3CC[C@@H](C3)F)C4=C(C=CC(=C4)F)F

Computed descriptors from PubChem (CID 146014435), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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