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EBI-907

CAT: 0013-GTR19209555-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209555-01Size:25 mg
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Description
EBI-907 is a potent, orally bioavailable B-RafV600E inhibitor with single-digit nanomolar IC50 (4.9 nM), demonstrating >10-fold greater potency than Vemurafenib in cellular assays. It effectively inhibits proliferation and Erk phosphorylation in BRAF (V600E) -dependent cell lines and shows activity against other kinases like BRK and FGFR1, supporting its use in oncology research for in vitro and in vivo studies.
CAS Number
1581764-31-9
Field of Research
Signal Transduction
Smiles
O (C) C1=CC2=C3C (=NN=C3NC=C2C=C1C4=C (Cl) C (NS (CCCF) (=O) =O) =CC=C4F) C5CC5
Molecular Formula
C23H21ClF2N4O3S
Molecular Weight
506.95
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-(2-chloro-3-(1-cyclopropyl-8-methoxy-3H-pyrazolo[3,4-c]isoquinolin-7-yl)-4-fluorophenyl)-3-fluoropropane-1-sulfonamide
CAS Number1581764-31-9
PubChem CID73427153
IUPAC NameN-[2-chloro-3-(1-cyclopropyl-8-methoxy-2H-pyrazolo[3,4-c]isoquinolin-7-yl)-4-fluorophenyl]-3-fluoropropane-1-sulfonamide
Molecular FormulaC23H21ClF2N4O3S
Molecular Weight507.0
XLogP4.6
Topological Polar Surface Area105
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Heavy Atom Count34
Formal Charge0
Complexity817
SMILES
COC1=C(C=C2C=NC3=NNC(=C3C2=C1)C4CC4)C5=C(C=CC(=C5Cl)NS(=O)(=O)CCCF)F
InChI
InChI=1S/C23H21ClF2N4O3S/c1-33-18-10-14-13(11-27-23-20(14)22(28-29-23)12-3-4-12)9-15(18)19-16(26)5-6-17(21(19)24)30-34(31,32)8-2-7-25/h5-6,9-12,30H,2-4,7-8H2,1H3,(H,27,28,29)
InChIKey
JSKJFDXTKYWPAH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-chloro-3-(1-cyclopropyl-8-methoxy-3H-pyrazolo[3,4-c]isoquinolin-7-yl)-4-fluorophenyl)-3-fluoropropane-1-sulfonamide
CAS: 1581764-31-9
CID: 73427153
Formula: C23H21ClF2N4O3S
MW: 507.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight507.0
XLogP34.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Exact Mass506.0990957
Monoisotopic Mass506.0990957
Topological Polar Surface Area105 Ų
Heavy Atom Count34
Formal Charge0
Complexity817
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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