Products for Research Use Only
RegisterLogin

(Rac) -Vepdegestrant

CAT: 0804-HY-138642ASize: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-138642ASize:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
(Rac) -Vepdegestrant is the isomer of Vepdegestrant. Vepdegestrant ((R) -Lavandulol) is an orally active PROTAC estrogen receptor degrader against breast cancer. Vepdegestrant is a hetero-bifunctional molecule that facilitates the interactions between estrogen receptor alpha and an intracellular E3 ligase complex. Vepdegestrant leads to the ubiquitylation and subsequent degradation of estrogen receptors via the proteasome. Vepdegestrant robustly degrades ER in ER-positive breast cancer cell lines with a half-maximal degradation concentration (DC50) of about 2 nM[1].
CAS Number
2229711-08-2
Product Name Alternative
(Rac) -ARV-471
UNSPSC
12352005
Target
Estrogen Receptor/ERR; PROTACs
Type
Reference compound
Related Pathways
PROTAC; Vitamin D Related/Nuclear Receptor
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/rac-vepdegestrant.html
Smiles
O=C(C(N(CC1=C2C=CC(N3CCN(CC4CCN(C5=CC=C([C@H]6[C@@H](C7=CC=CC=C7)CCC8=C6C=CC(O)=C8)C=C5)CC4)CC3)=C1)C2=O)CC9)NC9=O
Molecular Formula
C45H49N5O4
Molecular Weight
723.90
References & Citations
[1]Lin X, et al. Targeting estrogen receptor α for degradation with PROTACs: A promising approach to overcome endocrine resistance. Eur J Med Chem. 2020;206:112689.|[2]Hermida-Prado F, et al. Endocrine Therapy Synergizes with SMAC Mimetics to Potentiate Antigen Presentation and Tumor Regression in Hormone Receptor-Positive Breast Cancer. Cancer Res. 2023 Oct 2;83 (19) :3284-3304.|[3]JJ Flanagan, et al. Abstract P5-04-18: ARV-471, an oral estrogen receptor PROTAC degrader for breast cancer.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

(Rac)-Vepdegestrant
CAS Number2229711-08-2
PubChem CID134579471
IUPAC Name3-[6-[4-[[1-[4-[(1R,2S)-6-hydroxy-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl]phenyl]piperidin-4-yl]methyl]piperazin-1-yl]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
Molecular FormulaC45H49N5O4
Molecular Weight723.9
XLogP6.4
Topological Polar Surface Area96.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count54
Formal Charge0
Complexity1310
SMILES
C1CC2=C(C=CC(=C2)O)[C@H]([C@H]1C3=CC=CC=C3)C4=CC=C(C=C4)N5CCC(CC5)CN6CCN(CC6)C7=CC8=C(C=C7)C(=O)N(C8)C9CCC(=O)NC9=O
InChI
InChI=1S/C45H49N5O4/c51-37-12-15-39-33(27-37)8-13-38(31-4-2-1-3-5-31)43(39)32-6-9-35(10-7-32)48-20-18-30(19-21-48)28-47-22-24-49(25-23-47)36-11-14-40-34(26-36)29-50(45(40)54)41-16-17-42(52)46-44(41)53/h1-7,9-12,14-15,26-27,30,38,41,43,51H,8,13,16-25,28-29H2,(H,46,52,53)/t38-,41?,43+/m1/s1
InChIKey
TZZDVPMABRWKIZ-MFTLXVFQSA-N
Chemical Structure
2D Structure
2D structure of (Rac)-Vepdegestrant
CAS: 2229711-08-2
CID: 134579471
Formula: C45H49N5O4
MW: 723.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight723.9
XLogP36.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass723.37845506
Monoisotopic Mass723.37845506
Topological Polar Surface Area96.4 Ų
Heavy Atom Count54
Formal Charge0
Complexity1310
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-138642-01Vepdegestrant
HY-138642SVepdegestrant-d5
HY-W475120(Rac) -Dihydrocarveol
HY-W1005647-01(rac) -Isoleucine
HY-W686760(Rac) -Bromamphenicol
HY-W354544(Rac) -Hexestrol
HY-W144704-01(rac) -Dihydrophytol
HY-115441(Rac) -Luliconazole
HY-109106B-01(Rac) -Upacicalcet
HY-101202A-01(Rac) -SNC80

Alternative Products

CatalogName
GTR19267153-01(Rac) -Vepdegestrant
GTR19170576-01Vepdegestrant
C14508-25mgVepdegestrant (ARV471)
A23912-50Vepdegestrant (ARV471) 50mg
A23912-5Vepdegestrant (ARV471) 5mg
A23912-1Vepdegestrant (ARV471) 1mg
A23912-10Vepdegestrant (ARV471) 10mg
AR-E10828-01Rac-Etrasimod (rac-APD334)
A11136-10(Rac) -PF-4136309 ((Rac) -INCB8761) 10mg
A11136-5(Rac) -PF-4136309 ((Rac) -INCB8761) 5mg

Popular Products