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Chemical structure of Zemprocitinib

GC75793

Zemprocitinib

Also known as N-[3-(3,5,8,10-tetrazatricyclo[7.3.0.02,6]dodeca-1,4,6,8,11-pentaen-3-yl)-1-bicyclo[1.1.1]pentanyl]propane-1-sulfonamide

Zemprocitinib (Compound 1) is a Janus kinase (JAK) inhibitor

ChemicalCAS2417414-44-7MW345.42FormulaC16H19N5O2S
CAS number
2417414-44-7
Molecular weight
345.42
Formula
C16H19N5O2S
Solubility
DMSO： 125 mg/mL (361·88 mM; Need ultrasonic)
InChIKey
WBKCMWRKRQABQF-UHFFFAOYSA-N
Catalogue number
GC75793
Brand
GLPBIO
Computed properties PubChem CID 152231544 · XLogP 1.1 · TPSA 101 Ų · H-bond donors 2
XLogP
1.1
TPSA
101 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
24

SMILES CCCS(=O)(=O)NC12CC(C1)(C2)N3C=NC4=CN=C5C(=C43)C=CN5

Computed descriptors from PubChem (CID 152231544), 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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Documents
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