Products for Research Use Only
RegisterLogin

BAY-593

CAT: 0013-GTR19235564-02Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19235564-02Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
BAY-593 is a potent and orally bioavailable inhibitor of geranylgeranyltransferase I (GGTase-I) . Its anti-tumor activity is achieved through the inhibition of the YAP1/TAZ signaling pathway, as demonstrated in vivo. This small molecule is a valuable research tool for studying Hippo pathway dysregulation in cancer models.
CAS Number
2413020-56-9
Field of Research
Metabolism Research, Stem Cell & Developmental Biology
Smiles
O (C) C1=C ([C@H]2C3 (CCN (C ([C@] ([C@@] (F) (F) F) (OC) C4=CC=CC=C4) =O) CC3) CCNC2) C=CC=C1
Molecular Formula
C26H31F3N2O3
Molecular Weight
476.53
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CID 149967332
CAS Number2413020-56-9
PubChem CID149967332
IUPAC Name(2R)-3,3,3-trifluoro-2-methoxy-1-[(11R)-11-(2-methoxyphenyl)-3,9-diazaspiro[5.5]undecan-3-yl]-2-phenylpropan-1-one
Molecular FormulaC26H31F3N2O3
Molecular Weight476.5
XLogP4.3
Topological Polar Surface Area50.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity689
SMILES
COC1=CC=CC=C1[C@@H]2CNCCC23CCN(CC3)C(=O)[C@](C4=CC=CC=C4)(C(F)(F)F)OC
InChI
InChI=1S/C26H31F3N2O3/c1-33-22-11-7-6-10-20(22)21-18-30-15-12-24(21)13-16-31(17-14-24)23(32)25(34-2,26(27,28)29)19-8-4-3-5-9-19/h3-11,21,30H,12-18H2,1-2H3/t21-,25+/m0/s1
InChIKey
CUNCJCWHVHIRLT-SQJMNOBHSA-N
Chemical Structure
2D Structure
2D structure of CID 149967332
CAS: 2413020-56-9
CID: 149967332
Formula: C26H31F3N2O3
MW: 476.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight476.5
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass476.22867734
Monoisotopic Mass476.22867734
Topological Polar Surface Area50.8 Ų
Heavy Atom Count34
Formal Charge0
Complexity689
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19157101-01TAK-593
GTR19174125-01TAK-593
GTR19276162-01CRBN ligand-593
GTR19219736-01BAY 1892005
GTR19217383-01BAY-1436032
GTR19212481-01BAY 1214784
GTR19212430-01BAY 2965501
GTR19212149-01BAY-7081
GTR19211749-01BAY-4931
GTR19210497-01BAY-771

Alternative Products

CatalogName
E1976-1mgBAY-593
T201377-01BAY 593
HY-161573B-01BAY-593 (hydrochloride)
T89195-01(7S) -BAY-593
HY-15506-01TAK-593

Popular Products