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Disarib

CAT: 1410-M13120Size: 1 EachDry Ice: NoHazardous: No
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Description
Disarib is a novel BCL2-specific inhibitor that binds predominantly to the BH1 domain.
CAS Number
1998149-15-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
547.855
Molecular Formula
C26H16BrClN4OS
Notes
Research use only, not for human use.
Receptor
Bcl-2

Chemical Information

Disarib
CAS Number1998149-15-7
PubChem CID154824611
IUPAC Name(3Z)-3-[[6-(4-bromophenyl)-2-[(4-chlorophenyl)methyl]imidazo[2,1-b][1,3,4]thiadiazol-5-yl]methylidene]-1H-indol-2-one
Molecular FormulaC26H16BrClN4OS
Molecular Weight547.9
XLogP6.8
Topological Polar Surface Area87.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count34
Formal Charge0
Complexity785
SMILES
C1=CC=C2C(=C1)/C(=C/C3=C(N=C4N3N=C(S4)CC5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Br)/C(=O)N2
InChI
InChI=1S/C26H16BrClN4OS/c27-17-9-7-16(8-10-17)24-22(14-20-19-3-1-2-4-21(19)29-25(20)33)32-26(30-24)34-23(31-32)13-15-5-11-18(28)12-6-15/h1-12,14H,13H2,(H,29,33)/b20-14-
InChIKey
XGKHRPXTCRZBFB-ZHZULCJRSA-N
Chemical Structure
2D Structure
2D structure of Disarib
CAS: 1998149-15-7
CID: 154824611
Formula: C26H16BrClN4OS
MW: 547.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight547.9
XLogP36.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass545.99167
Monoisotopic Mass545.99167
Topological Polar Surface Area87.5 Ų
Heavy Atom Count34
Formal Charge0
Complexity785
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19154152Disarib

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