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KB-208

CAT: 0013-GTR19250464-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19250464-02Size:10 mg
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Description
KB-208 is a small molecule phagocytosis inhibitor that exacerbates immune thrombocytopenia (ITP) in murine models at 1 mg/kg. It is a selective research tool for immunology, useful for in vivo studies of platelet clearance mechanisms, as it does not affect other hematological parameters or induce serum toxicity.
CAS Number
1282128-68-0
Smiles
O=C (OC) CC1CCN (C (=O) C2=CC (=NN2C=3C=CC=CC3) C=4SC=CC4) CC1
Molecular Formula
C22H23N3O3S
Molecular Weight
409.501
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

methyl (1-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-5-yl]carbonyl}piperidin-4-yl)acetate
CAS Number1282128-68-0
PubChem CID52902668
IUPAC Namemethyl 2-[1-(1-phenyl-3-thiophen-2-ylpyrazole-5-carbonyl)piperidin-4-yl]acetate
Molecular FormulaC22H23N3O3S
Molecular Weight409.5
XLogP3.6
Topological Polar Surface Area92.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count29
Formal Charge0
Complexity576
SMILES
COC(=O)CC1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CS4
InChI
InChI=1S/C22H23N3O3S/c1-28-21(26)14-16-9-11-24(12-10-16)22(27)19-15-18(20-8-5-13-29-20)23-25(19)17-6-3-2-4-7-17/h2-8,13,15-16H,9-12,14H2,1H3
InChIKey
JBTAEQNNSPGXHO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of methyl (1-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-5-yl]carbonyl}piperidin-4-yl)acetate
CAS: 1282128-68-0
CID: 52902668
Formula: C22H23N3O3S
MW: 409.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight409.5
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass409.14601278
Monoisotopic Mass409.14601278
Topological Polar Surface Area92.7 Ų
Heavy Atom Count29
Formal Charge0
Complexity576
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

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