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Pomalidomide 4'-alkylC8-acid

CAT: 0931-T36263Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T36263Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2305936-70-1
Target
E3 Ligase Ligand-Linker Conjugate, Others
Related Pathways
Others, PROTAC
Bioactivity
Functionalized cereblon ligand for PROTAC research and development; incorporates an E3 ligase ligand plus an alkylC8 linker with terminal acid ready for conjugation to a target protein ligand. Part of a range of functionalized tool molecules for PROTAC R&D. PROTAC is a registered trademark of Arvinas Operations, Inc., and is used under license.
Smiles
OC(=O)CCCCCCCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12
Molecular Formula
C22H27N3O6
Molecular Weight
429.473
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pomalidomide 4'-alkylC8-acid
CAS Number2305936-70-1
PubChem CID139467481
IUPAC Name9-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]nonanoic acid
Molecular FormulaC22H27N3O6
Molecular Weight429.5
XLogP3.1
Topological Polar Surface Area133
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Heavy Atom Count31
Formal Charge0
Complexity724
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NCCCCCCCCC(=O)O
InChI
InChI=1S/C22H27N3O6/c26-17-12-11-16(20(29)24-17)25-21(30)14-8-7-9-15(19(14)22(25)31)23-13-6-4-2-1-3-5-10-18(27)28/h7-9,16,23H,1-6,10-13H2,(H,27,28)(H,24,26,29)
InChIKey
OGMJVYCYINHWEJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pomalidomide 4'-alkylC8-acid
CAS: 2305936-70-1
CID: 139467481
Formula: C22H27N3O6
MW: 429.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight429.5
XLogP33.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Exact Mass429.18998559
Monoisotopic Mass429.18998559
Topological Polar Surface Area133 Ų
Heavy Atom Count31
Formal Charge0
Complexity724
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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HY-131863-01Pomalidomide 4'-alkylC8-acid
bs-7193C-01Pomalidomide 4-alkylC8-acid
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