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Pomalidomide-CO-C5-azide

CAT: 0804-HY-160077-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-160077-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Pomalidomide-CO-C5-azide (Compound PA) is a ligand for E3 ligase bearing a bioorthogonal group azide. Pomalidomide-CO-C5-azide can be used to synthesize PROTACs with anticancer activity[1].
CAS Number
2227423-33-6
UNSPSC
12352005
Hazard Statement
H315-H319-H335-H372
Target
E3 Ligase Ligand-Linker Conjugates
Type
Reference compound
Related Pathways
PROTAC
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/pomalidomide-co-c5-azide.html
Solubility
10 mM in DMSO
Smiles
[N-]=[N+]=NCCCCCC(NC1=CC=CC(C(N2C3C(NC(CC3)=O)=O)=O)=C1C2=O)=O
Molecular Formula
C19H20N6O5
Molecular Weight
412.40
Precautions
P260-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501
References & Citations
[1]Jie Zhang, et al. Self-assembly protein degradation agent with tumor cell specificity and preparation method and application thereof. Patent CN115260161A.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Pomalidomide-CO-C5-azide
CAS Number2227423-33-6
PubChem CID135389847
IUPAC Name6-azido-N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]hexanamide
Molecular FormulaC19H20N6O5
Molecular Weight412.4
XLogP1.8
Topological Polar Surface Area127
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity792
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)CCCCCN=[N+]=[N-]
InChI
InChI=1S/C19H20N6O5/c20-24-21-10-3-1-2-7-14(26)22-12-6-4-5-11-16(12)19(30)25(18(11)29)13-8-9-15(27)23-17(13)28/h4-6,13H,1-3,7-10H2,(H,22,26)(H,23,27,28)
InChIKey
XCKILAXDBXPQRD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pomalidomide-CO-C5-azide
CAS: 2227423-33-6
CID: 135389847
Formula: C19H20N6O5
MW: 412.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight412.4
XLogP31.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass412.14951776
Monoisotopic Mass412.14951776
Topological Polar Surface Area127 Ų
Heavy Atom Count30
Formal Charge0
Complexity792
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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