Products for Research Use Only
RegisterLogin

TBK1/IKKε-IN-4

CAT: 0013-GTR19190059-01Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19190059-01Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
TBK1/IKKε-IN-4 is a highly selective 6-aminopyrazolopyrimidine inhibitor of TBK1 (IC50=13 nM) and IKKε (IC50=59 nM) . It shows minimal off-target activity against related kinases and is a valuable tool for studying innate immunity, inflammation, and oncology in cellular and in vivo models.
CAS Number
1381930-17-1
Field of Research
Signal Transduction
Smiles
COc1ccc (cc1) -n1ncc2cnc (Nc3cc (OC) c (OC) c (OCCCN4CCN (C) CC4) c3) nc12
Molecular Formula
C28H35N7O4
Molecular Weight
533.62
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(3,4-Dimethoxy-5-(3-(4-methylpiperazin-1-yl)propoxy)phenyl)-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CAS Number1381930-17-1
PubChem CID121230617
IUPAC NameN-[3,4-dimethoxy-5-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-6-amine
Molecular FormulaC28H35N7O4
Molecular Weight533.6
XLogP3.8
Topological Polar Surface Area99
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count11
Heavy Atom Count39
Formal Charge0
Complexity722
SMILES
CN1CCN(CC1)CCCOC2=CC(=CC(=C2OC)OC)NC3=NC=C4C=NN(C4=N3)C5=CC=C(C=C5)OC
InChI
InChI=1S/C28H35N7O4/c1-33-11-13-34(14-12-33)10-5-15-39-25-17-21(16-24(37-3)26(25)38-4)31-28-29-18-20-19-30-35(27(20)32-28)22-6-8-23(36-2)9-7-22/h6-9,16-19H,5,10-15H2,1-4H3,(H,29,31,32)
InChIKey
PVQUVXVUIZZLMP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(3,4-Dimethoxy-5-(3-(4-methylpiperazin-1-yl)propoxy)phenyl)-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CAS: 1381930-17-1
CID: 121230617
Formula: C28H35N7O4
MW: 533.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight533.6
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count11
Exact Mass533.27505262
Monoisotopic Mass533.27505262
Topological Polar Surface Area99 Ų
Heavy Atom Count39
Formal Charge0
Complexity722
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19189232TBK1/IKKε-IN-6
GTR19204673-01TBK1/IKKε-IN-1
GTR19174433-01TBK1/IKKε-IN-2
GTR19234588-01TBK1/IKKε-IN-3
GTR19166203-01TBK1/IKKε-IN-5
GTR19263081-01TBK1 degrader-4
GTR19187505-01IKK-IN-4
GTR19222578TBK1 control PROTAC 4
GTR17945323-01TBK1 Antibody
GTR18589904-01TBK1 Antibody

Alternative Products

CatalogName
HY-124652-01TBK1/IKKε-IN-4
M21640-01TBK1/IKKε-IN-5
T87496-01TBK1/IKKε-IN-3
C07173-01TBK1/IKKε-IN-2
HY-U00457TBK1/IKKε-IN-1
HY-138931TBK1/IKKε-IN-6

Popular Products