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GS-9973 100mg

CAT: 0628-A13884-100Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0628-A13884-100Size:100 mg
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CAS Number
1229208-44-9

Chemical Information

Entospletinib

Entospletinib has been used in trials studying the treatment of Oncology, Follicular Lymphoma, B-cell Malignancies, Mantle Cell Lymphoma, and Non-Hodgkin Lymphoma, among others.

CAS Number1229208-44-9
PubChem CID59473233
IUPAC Name6-(1H-indazol-6-yl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
Molecular FormulaC23H21N7O
Molecular Weight411.5
XLogP3.6
Topological Polar Surface Area83.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count31
Formal Charge0
Complexity594
SMILES
C1COCCN1C2=CC=C(C=C2)NC3=NC(=CN4C3=NC=C4)C5=CC6=C(C=C5)C=NN6
InChI
InChI=1S/C23H21N7O/c1-2-17-14-25-28-20(17)13-16(1)21-15-30-8-7-24-23(30)22(27-21)26-18-3-5-19(6-4-18)29-9-11-31-12-10-29/h1-8,13-15H,9-12H2,(H,25,28)(H,26,27)
InChIKey
XSMSNFMDVXXHGJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Entospletinib
CAS: 1229208-44-9
CID: 59473233
Formula: C23H21N7O
MW: 411.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight411.5
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass411.18075832
Monoisotopic Mass411.18075832
Topological Polar Surface Area83.4 Ų
Heavy Atom Count31
Formal Charge0
Complexity594
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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Alternative Products

CatalogName
sc-490337CGS 9973
B3553-25GS-9973
MBS384797-01GS-9973 (Entospletinib)
C12750-10mM/1mLEntospletinib (GS-9973)
MBS130676-01Entospletinib? GS-9973
MBS131349Selonsertib (GS-4997; GS4997; GS 4997)
BA2269-10GS-621763
B8461-25GS-441524

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