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N3-D-Dab (Boc) -OH

CAT: 0804-HY-151729Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-151729Size:1 Each
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Description
N3-D-Dab (Boc) -OH is a click chemistry reagent containing an Azide[1]. N3-D-Dab (Boc) -OH 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.
CAS Number
1922891-74-4
UNSPSC
12352211
Target
ADC Linker
Type
Reference compound
Related Pathways
Antibody-drug Conjugate/ADC Related
Applications
Cancer-programmed cell death
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/n3-d-dab-boc-oh.html
Solubility
10 mM in DMSO
Smiles
CC(C)(C)OC(NCC[C@H](C(O)=O)N=[N+]=[N-])=O
Molecular Formula
C9H16N4O4
Molecular Weight
244.25
References & Citations
[1]Meng G, et al. Modular click chemistry libraries for functional screens using a diazotizing reagent. Nature. 2019 Oct;574 (7776) :86-89.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

N3-D-Dab(Boc)-OH
CAS Number1922891-74-4
PubChem CID75409968
IUPAC Name(2R)-2-azido-4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
Molecular FormulaC9H16N4O4
Molecular Weight244.25
XLogP2
Topological Polar Surface Area90
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count17
Formal Charge0
Complexity330
SMILES
CC(C)(C)OC(=O)NCC[C@H](C(=O)O)N=[N+]=[N-]
InChI
InChI=1S/C9H16N4O4/c1-9(2,3)17-8(16)11-5-4-6(7(14)15)12-13-10/h6H,4-5H2,1-3H3,(H,11,16)(H,14,15)/t6-/m1/s1
InChIKey
JLMWKZYQNHSSAD-ZCFIWIBFSA-N
Chemical Structure
2D Structure
2D structure of N3-D-Dab(Boc)-OH
CAS: 1922891-74-4
CID: 75409968
Formula: C9H16N4O4
MW: 244.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight244.25
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass244.11715500
Monoisotopic Mass244.11715500
Topological Polar Surface Area90 Ų
Heavy Atom Count17
Formal Charge0
Complexity330
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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T89725-01N3-D-Dab (Boc) -OH
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BIBP1065-01N3-Dab (Boc)
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