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Vepdegestrant

CAT: 1596-AR-A07160-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-A07160-01Size:10 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2229711-68-4
Synonyms
(S) -3- (5- (4- ((1- (4- ((1R,2S) -6-Hydroxy-2-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl) phenyl) piperidin-4-yl) methyl) piperazin-1-yl) -1-oxoisoindolin-2-yl) piperidine-2,6-dione
Molecular Formula
C45H49N5O4
Molecular Weight
723.92
API Name
Arv-471

Chemical Information

Arv-471

Vepdegestrant is under investigation in clinical trial NCT05909397 (A Study of ARV-471 (PF-07850327) Plus Palbociclib Versus Letrozole Plus Palbociclib in Participants With Estrogen Receptor Positive, Human Epidermal Growth Factor Negative Advanced Breast Cancer).

CAS Number2229711-68-4
PubChem CID134562533
IUPAC Name(3S)-3-[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)[C@H]9CCC(=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-XMOGEVODSA-N
Chemical Structure
2D Structure
2D structure of Arv-471
CAS: 2229711-68-4
CID: 134562533
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 Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-138642-01Vepdegestrant
GTR19267153-01(Rac) -Vepdegestrant
C14508-25mgVepdegestrant (ARV471)
HY-138642SVepdegestrant-d5
A23912-50Vepdegestrant (ARV471) 50mg
A23912-5Vepdegestrant (ARV471) 5mg
A23912-1Vepdegestrant (ARV471) 1mg
A23912-10Vepdegestrant (ARV471) 10mg

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