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JAK1-IN-3 5mg

CAT: 0628-A19251-5Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0628-A19251-5Size:5 mg
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CAS Number
2091134-68-6

Chemical Information

Golidocitinib

Golidocitinib is an orally available inhibitor of Janus-associated kinase 1 (JAK1), with potential antineoplastic activity. Upon oral administration, golidocitinib inhibits JAK-dependent signaling and may lead to an inhibition of cellular proliferation in JAK1-overexpressing tumor cells. The JAK-STAT (signal transducer and activator of transcription) signaling pathway is a major mediator of cytokine activity and is often dysregulated in a variety of tumor cell types. Additionally, JAK1 may be a primary driver of STAT3 phosphorylation and signaling, which plays a role in neoplastic transformation, resistance to apoptosis, tumor angiogenesis, metastasis, immune evasion, and treatment resistance.

CAS Number2091134-68-6
PubChem CID126715380
IUPAC Name(2R)-N-[3-[2-[(3-methoxy-1-methylpyrazol-4-yl)amino]pyrimidin-4-yl]-1H-indol-7-yl]-2-(4-methylpiperazin-1-yl)propanamide
Molecular FormulaC25H31N9O2
Molecular Weight489.6
XLogP1.9
Topological Polar Surface Area116
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Heavy Atom Count36
Formal Charge0
Complexity736
SMILES
C[C@H](C(=O)NC1=CC=CC2=C1NC=C2C3=NC(=NC=C3)NC4=CN(N=C4OC)C)N5CCN(CC5)C
InChI
InChI=1S/C25H31N9O2/c1-16(34-12-10-32(2)11-13-34)23(35)28-20-7-5-6-17-18(14-27-22(17)20)19-8-9-26-25(29-19)30-21-15-33(3)31-24(21)36-4/h5-9,14-16,27H,10-13H2,1-4H3,(H,28,35)(H,26,29,30)/t16-/m1/s1
InChIKey
CVCVOSPZEVINRM-MRXNPFEDSA-N
Chemical Structure
2D Structure
2D structure of Golidocitinib
CAS: 2091134-68-6
CID: 126715380
Formula: C25H31N9O2
MW: 489.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight489.6
XLogP31.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass489.26007127
Monoisotopic Mass489.26007127
Topological Polar Surface Area116 Ų
Heavy Atom Count36
Formal Charge0
Complexity736
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS3843708-01JAK1-IN-3
HY-143885JAK1/TYK2-IN-3
GTR19274198-01JAK1/2-IN-3
sc-376996JAK1 (B-3)
sc-376996 ACJAK1 (B-3) AC
BZ64205PCMV6-JAK1-3*FLAG
sc-376996 HRPJAK1 (B-3) HRP
sc-376996 FITCJAK1 (B-3) FITC
sc-376996 PEJAK1 (B-3) PE
321249-01JAK1

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