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Chemical structure of Necrostatin-34

GC62316

Necrostatin-34

Also known as 2-[[5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide

Necrostatin-34 (Nec-34), a RIPK1 kinase inhibitor, stabilizes RIPK1 kinase in an inactive conformation by occupying a distinct binding pocket in the kinase domain

ChemicalCAS375835-43-1MW384.48FormulaC18H16N4O2S2
CAS number
375835-43-1
Molecular weight
384.48
Formula
C18H16N4O2S2
Solubility
DMSO ： 125 mg/mL (325·11 mM; Need ultrasonic)
InChIKey
LOQIRQHGJVGIEL-UHFFFAOYSA-N
Catalogue number
GC62316
Brand
GLPBIO
Computed properties PubChem CID 3841655 · XLogP 2.2 · TPSA 148 Ų · H-bond donors 2
XLogP
2.2
TPSA
148 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
26

SMILES CC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=NC=CS3

Computed descriptors from PubChem (CID 3841655), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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