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JANEX-1 hydrochloride

CAT: 0931-T88730-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T88730-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
188829-39-2
Target
JAK
Related Pathways
Chromatin/Epigenetic, JAK/STAT signaling, Tyrosine Kinase/Adaptors, Angiogenesis, Stem Cells
Bioactivity
JANEX-1 (WHI-P131) hydrochloride is an effective and specific JAK3 inhibitor with a Ki of 2.3 μM and an IC50 of 78 μM. It does not inhibit JAK1 and JAK2.
Smiles
Cl.OC1=CC=C(C=C1)NC=2N=CN=C3C=C(OC)C(OC)=CC32
Molecular Formula
C16H16ClN3O3
Molecular Weight
333.77
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-(4-Hydroxyanilino)-6,7-dimethoxyquinazoline hydrochloride
CAS Number188829-39-2
PubChem CID22022153
IUPAC Name4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenol;hydrochloride
Molecular FormulaC16H16ClN3O3
Molecular Weight333.77
Topological Polar Surface Area76.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity350
SMILES
COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)O)OC.Cl
InChI
InChI=1S/C16H15N3O3.ClH/c1-21-14-7-12-13(8-15(14)22-2)17-9-18-16(12)19-10-3-5-11(20)6-4-10;/h3-9,20H,1-2H3,(H,17,18,19);1H
InChIKey
HNJNNCPPISFBGR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(4-Hydroxyanilino)-6,7-dimethoxyquinazoline hydrochloride
CAS: 188829-39-2
CID: 22022153
Formula: C16H16ClN3O3
MW: 333.77
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight333.77
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass333.0880191
Monoisotopic Mass333.0880191
Topological Polar Surface Area76.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity350
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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