Products for Research Use Only

Ald-Ph-PEG4-NH-Boc

CAT: 0931-T14168-01Size: 100 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T14168-01Size:100 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2110449-01-7
Target
Others, PROTAC Linker
Related Pathways
Others, PROTAC
Bioactivity
Ald-Ph-PEG4-NH-Boc, a PEG-based linker for PROTACs, connects two essential ligands, crucial for forming PROTAC molecules. This linker facilitates selective protein degradation by leveraging the ubiquitin-proteasome system within cells.
Smiles
O=CC1=CC=C(C=C1)C(=O)NCCOCCOCCOCCONC(=O)OC(C)(C)C
Molecular Formula
C21H32N2O8
Molecular Weight
440.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ald-Ph-PEG3-O-NH-Boc
CAS Number2110449-01-7
PubChem CID129012717
IUPAC Nametert-butyl N-[2-[2-[2-[2-[(4-formylbenzoyl)amino]ethoxy]ethoxy]ethoxy]ethoxy]carbamate
Molecular FormulaC21H32N2O8
Molecular Weight440.5
XLogP1
Topological Polar Surface Area121
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count17
Heavy Atom Count31
Formal Charge0
Complexity516
SMILES
CC(C)(C)OC(=O)NOCCOCCOCCOCCNC(=O)C1=CC=C(C=C1)C=O
InChI
InChI=1S/C21H32N2O8/c1-21(2,3)31-20(26)23-30-15-14-29-13-12-28-11-10-27-9-8-22-19(25)18-6-4-17(16-24)5-7-18/h4-7,16H,8-15H2,1-3H3,(H,22,25)(H,23,26)
InChIKey
HPQOIZCKUNSTRO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ald-Ph-PEG3-O-NH-Boc
CAS: 2110449-01-7
CID: 129012717
Formula: C21H32N2O8
MW: 440.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight440.5
XLogP31
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count17
Exact Mass440.21586598
Monoisotopic Mass440.21586598
Topological Polar Surface Area121 Ų
Heavy Atom Count31
Formal Charge0
Complexity516
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes