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Chemical structure of WHI-P258

GC40740

WHI-P258

Also known as 6,7-dimethoxy-N-phenylquinazolin-4-amine

WHI-P258 is a quinazoline compound that modeling studies suggested would bind to the active site of JAK3 with an estimated Ki value of 72 μM

ChemicalCAS21561-09-1MW281.3FormulaC16H15N3O2
CAS number
21561-09-1
Molecular weight
281.3
Formula
C16H15N3O2
Solubility
DMF: 25 mg/ml,DMF:PBS(pH 7·2)(1:1): 0·5 mg/ml,DMSO: 15 mg/ml
InChIKey
MJKCGAHOCZLYDG-UHFFFAOYSA-N
Catalogue number
GC40740
Brand
GLPBIO
Computed properties PubChem CID 3798 · XLogP 3.4 · TPSA 56.3 Ų · H-bond donors 1
XLogP
3.4
TPSA
56.3 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21

SMILES COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC=C3)OC

Computed descriptors from PubChem (CID 3798), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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