HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Biotin-PEG2-C6-Azide

HCID 178790639
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1011268-29-3
Standard SMILES
[N-]=[N+]=NCCCCCC(=O)NCCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21
InChIKey
NYAZUAAGKILBHO-WFXMLNOXSA-N
Molecular formula
C22H39N7O5S
Average molar mass
513.7 g/mol
Monoisotopic mass
513.27333854

Names & identifiers

Preferred name
Biotin-PEG2-C6-Azide
IUPAC
N-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethyl]-6-azidohexanamide
English name
Biotin-PEG2-C6-Azide
Molecular formula
C22H39N7O5S
Molecular weight
513.66

Names & synonyms

Biotin-PEG2-C6-Azide1011268-29-36-azido-N-(2-(2-(2-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)ethoxy)ethoxy)ethyl)hexanamideMFCD28505538N-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethyl]-6-azidohexanamideorb2279272SCHEMBL30403099AKOS040741344BP-22694DA-51141MS-29538HY-117042
Show more names
Biotin-PEG2-C6-N3Biotin-PEG8-C6-Azide
CS-0063565T14585F986900

Database identifiers

CAS
1011268-29-3
PubChem CID
91757768

Properties

Computed structural propertiesFilling in

XLogP
1
Topological polar surface area
157 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
8
Rotatable bonds
20
Heavy atoms
35
Formal charge
0
Complexity
708

Physicochemical properties

storage temp.
2 · Storage temp. 2-8°C
form
Solid
color
White to off-white

Chemistry & industry

Applications · 2 items

DescriptionBiotin-PEG2-C6-azide is PEG linker containing a biotin group and an azide group. The azide group can react with either alkyne moiety in Cu(I)-catalyzed Click Chemistry reaction or DBCO moiety in copper-free Click Chemistry reaction to form a stable triazole linkage. The spacer arm helps to minimize steric hindrance involved with the binding to avidin molecules.

UsesBiotin-PEG2-C6-azide is a PEG-based PROTAC linker can be used in the synthesis of PROTAC. Biotin-PEG2-C6-azide is a click chemistry reagent, it contains an Azide group and can undergo copper-catalyzed azide-alkyne cycloaddition reaction (CuAAc) with molecules containing Alkyne groups. It can also undergo strain-promoted alkyne-azide cycloaddition (SPAAC) reactions with molecules containing DBCO or BCN groups.

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes