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N3-L-Val-OH (CHA)

CAT: 0804-HY-151661-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-151661-01Size:10 mg
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Description
N3-L-Val-OH (CHA) is a click chemistry containing an azide group, a valine derivative. N3-L-Val-OH (CHA) can also be used as a synthetic intermediate for Valaciclovir (Valacyclovir) [1]. It contains an azide group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing alkyne groups. It can also undergo ring strain-promoted alkyne-azide cycloaddition (SPAAC) with molecules containing DBCO or BCN groups.
CAS Number
1217462-63-9
Product Name Alternative
L-azidovaline (CHA)
UNSPSC
12352211
Hazard Statement
H315-H319-H335
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-l-val-oh-cha.html
Purity
99.15
Solubility
H2O : 125 mg/mL (ultrasonic)
Smiles
NC1CCCCC1.[N-]=[N+]=N[C@H](C(O)=O)C(C)C
Molecular Formula
C11H22N4O2
Molecular Weight
242.32
Precautions
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362+P364-P403+P233-P405-P501
References & Citations
[1]Hassan M Faidallah, et al. Synthesis, antibacterial properties and 2D-QSAR studies of quinolone-triazole conjugates. Eur J Med Chem. 2018 Jan 1;143:1524-1534.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, sealed storage, away from moisture and light)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

(S)-2-Azido Isovaleric Acid Cyclohexylammonium Salt
CAS Number1217462-63-9
PubChem CID66519949
IUPAC Name(2S)-2-azido-3-methylbutanoic acid;cyclohexanamine
Molecular FormulaC11H22N4O2
Molecular Weight242.32
Topological Polar Surface Area77.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity218
SMILES
CC(C)[C@@H](C(=O)O)N=[N+]=[N-].C1CCC(CC1)N
InChI
InChI=1S/C6H13N.C5H9N3O2/c7-6-4-2-1-3-5-6;1-3(2)4(5(9)10)7-8-6/h6H,1-5,7H2;3-4H,1-2H3,(H,9,10)/t;4-/m.0/s1
InChIKey
YMXXCNHHCIMTCV-VWMHFEHESA-N
Chemical Structure
2D Structure
2D structure of (S)-2-Azido Isovaleric Acid Cyclohexylammonium Salt
CAS: 1217462-63-9
CID: 66519949
Formula: C11H22N4O2
MW: 242.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight242.32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass242.17427596
Monoisotopic Mass242.17427596
Topological Polar Surface Area77.7 Ų
Heavy Atom Count17
Formal Charge0
Complexity218
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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T89666-01N3-L-Val-OH CHA
T89785-01N3-L-Cys (Trt) -OH CHA
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FP73114-01N3-Phe-OH·CHA
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MBS406808-01Boc-Lys(N3)-OH; CHA
MBS406801-01Boc-Dap(N3)-OH; CHA
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