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VH032-cyclopropane-F

CAT: 1568-C04728Size: 25 mgDry Ice: YesHazardous: No
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CAT#:1568-C04728Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2306193-99-5
Synonyms
VHL ligand 3, E3 ligase Ligand 19
SKU
C04728-25mg
Additionnal Information
VH032-cyclopropane-F is the VH032-based VHL ligand. VH032-cyclopropane-F can be connected to the ligand for protein (e.g., SMARCA BD ligand) by a linker to form PROTACs (e.g., PROTAC 1) . PROTAC 1 is a partial degrader of SMARCA2 and SMARCA4.
Storage Conditions
3 years-20°C powder 2 years-80°C in solvent

Chemical Information

VH032-cyclopropane-F
CAS Number2306193-99-5
PubChem CID137628614
IUPAC Name(2S,4R)-1-[(2S)-2-[(1-fluorocyclopropanecarbonyl)amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[2-hydroxy-4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide
Molecular FormulaC26H33FN4O5S
Molecular Weight532.6
XLogP3.2
Topological Polar Surface Area160
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Heavy Atom Count37
Formal Charge0
Complexity882
SMILES
CC1=C(SC=N1)C2=CC(=C(C=C2)CNC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)C4(CC4)F)O)O
InChI
InChI=1S/C26H33FN4O5S/c1-14-20(37-13-29-14)15-5-6-16(19(33)9-15)11-28-22(34)18-10-17(32)12-31(18)23(35)21(25(2,3)4)30-24(36)26(27)7-8-26/h5-6,9,13,17-18,21,32-33H,7-8,10-12H2,1-4H3,(H,28,34)(H,30,36)/t17-,18+,21-/m1/s1
InChIKey
OKBLHQUBMCCFKE-LVCYWYKZSA-N
Chemical Structure
2D Structure
2D structure of VH032-cyclopropane-F
CAS: 2306193-99-5
CID: 137628614
Formula: C26H33FN4O5S
MW: 532.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight532.6
XLogP33.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Exact Mass532.21556950
Monoisotopic Mass532.21556950
Topological Polar Surface Area160 Ų
Heavy Atom Count37
Formal Charge0
Complexity882
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

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Alternative Products

CatalogName
MBS3615552-01VH032-cyclopropane-F
A18417-50VH032-cyclopropane-F 50mg
A18417-10VH032-cyclopropane-F 10mg
A18417-250VH032-cyclopropane-F 250mg
A18417-100VH032-cyclopropane-F 100mg
A18417-25VH032-cyclopropane-F 25mg
A18417-5VH032-cyclopropane-F 5mg
GTR19263873-01VH032-cyclopropane-F-C4-CHO
GTR19265257-01(S, S, S) -VH032-cyclopropane-F
A18417-10mM-DVH032-cyclopropane-F 10mM * 1mL in DMSO

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