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BAY-293

CAT: 0013-GTR19162935-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19162935-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BAY-293 (BAY293, BAY 293) is a potent, cell-active SOS1 inhibitor that disrupts the KRAS-SOS1 interaction with IC50 of 21 nM; displays no significant activity against KRAS WT-CRAF RBD, CDC42 and EGFR (>20 uM) ; blocks reloading of KRAS with GTP, does not stabilize KRASWT or KRASG12C; inhibits the activation of RAS in HeLa cells with IC50 of 410 nM, efficiently inhibits pERK levels in K562 cells after incubation for 60 min without affecting total protein levels of ERK (IC50=180 nM) ; shows antiproliferative activity against wild-type KRAS cell lines (K562, MOLM-13; IC50~1 uM) and cell lines with KRASG12C mutation (NCI-H358, Calu-; IC50~3 uM) by preventing formation of the KRAS-SOS1 complex, also shows synergic antiproliferative effect with covalent KRASG12C inhibitor ARS-853; BAY-293 is a valuable chemical probe for investigation of the activation of KRAS by SOS1.
CAS Number
2244904-70-7
Product Name Alternative
BAY293 | BAY 293
Purity
>98% (HPLC)
Solubility
DMSO : ≥ 125 mg/mL 278.66 mM
Smiles
C[C@@H] (NC1=C2C=C (OC) C (OC) =CC2=NC (C) =N1) C3=CC (C4=CC=CC=C4CNC) =CS3
Molecular Formula
C25H28N4O2S
Molecular Weight
448.585
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
(R) -6,7-dimethoxy-2-methyl-N- (1- (4- (2- ((methylamino) methyl) phenyl) thiophen-2-yl) ethyl) quinazolin-4-amine

Chemical Information

Bay-293

BAY-293 is an organic molecular entity.

CAS Number2244904-70-7
PubChem CID137322663
IUPAC Name6,7-dimethoxy-2-methyl-N-[(1R)-1-[4-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]quinazolin-4-amine
Molecular FormulaC25H28N4O2S
Molecular Weight448.6
XLogP4.8
Topological Polar Surface Area96.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count32
Formal Charge0
Complexity584
SMILES
CC1=NC2=CC(=C(C=C2C(=N1)N[C@H](C)C3=CC(=CS3)C4=CC=CC=C4CNC)OC)OC
InChI
InChI=1S/C25H28N4O2S/c1-15(24-10-18(14-32-24)19-9-7-6-8-17(19)13-26-3)27-25-20-11-22(30-4)23(31-5)12-21(20)28-16(2)29-25/h6-12,14-15,26H,13H2,1-5H3,(H,27,28,29)/t15-/m1/s1
InChIKey
WEGLOYDTDILXDA-OAHLLOKOSA-N
Chemical Structure
2D Structure
2D structure of Bay-293
CAS: 2244904-70-7
CID: 137322663
Formula: C25H28N4O2S
MW: 448.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight448.6
XLogP34.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass448.19329732
Monoisotopic Mass448.19329732
Topological Polar Surface Area96.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity584
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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