Products for Research Use Only
RegisterLogin

Batabulin

CAT: 0931-T10460-04Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T10460-04Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
195533-53-0
Target
Apoptosis, Microtubule Associated
Related Pathways
Cytoskeletal Signaling, Apoptosis
Purity
0.9985
Bioactivity
Batabulin (T138067) is an antitumor compound that binds covalently and selectively to a subset of the β-tubulin isotypes, disrupting microtubule polymerization. This disruption affects cell morphology, induces cell-cycle arrest, and ultimately leads to apoptotic cell death.
Smiles
COc1ccc(NS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)cc1F
Molecular Formula
C13H7F6NO3S
Molecular Weight
371.26
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Batabulin

Batabulin is under investigation in clinical trial NCT00057382 (T138067 Versus Doxorubicin in Chemotherapy-naive, Unresectable, Hepatocellular Carcinoma Patients).

CAS Number195533-53-0
PubChem CID216324
IUPAC Name2,3,4,5,6-pentafluoro-N-(3-fluoro-4-methoxyphenyl)benzenesulfonamide
Molecular FormulaC13H7F6NO3S
Molecular Weight371.26
XLogP3
Topological Polar Surface Area63.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity516
SMILES
COC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C(=C(C(=C2F)F)F)F)F)F
InChI
InChI=1S/C13H7F6NO3S/c1-23-7-3-2-5(4-6(7)14)20-24(21,22)13-11(18)9(16)8(15)10(17)12(13)19/h2-4,20H,1H3
InChIKey
ROZCIVXTLACYNY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Batabulin
CAS: 195533-53-0
CID: 216324
Formula: C13H7F6NO3S
MW: 371.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight371.26
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass371.00508323
Monoisotopic Mass371.00508323
Topological Polar Surface Area63.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity516
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

Alternative Products

CatalogName
BA2983-25Batabulin
VHA53398-01Batabulin sodium
HY-13563A-01Batabulin (sodium)

Popular Products