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BTTAA

CAT: 0804-HY-100486-02Size: 10 mM - 1 mLDry Ice: NoHazardous: No
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CAT#:0804-HY-100486-02Size:10 mM - 1 mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BTTAA is a Cu (I) -stabilizing ligand, whch performs potently with ubiquitin Glu18AzF.
CAS Number
1334179-85-9
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Others
Type
Reference compound
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/BTTAA.html
Concentration
10mM
Purity
99.87
Solubility
H2O : 62.5 mg/mL (ultrasonic)
Smiles
O=C(O)CN1N=NC(CN(CC2=CN(C(C)(C)C)N=N2)CC3=CN(C(C)(C)C)N=N3)=C1
Molecular Formula
C19H30N10O2
Molecular Weight
430.51
Precautions
H302, H315, H319, H335
References & Citations
[1]Loh CT et al. Lanthanide tags for site-specific ligation to an unnatural amino acid and generation of pseudocontact shifts inproteins. Bioconjug Chem. 2013 Feb 20;24 (2) :260-8.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

2-(4-((Bis((1-tert-butyl-1H-1,2,3-triazol-4-yl)methyl)amino)methyl)-1H-1,2,3-triazol-1-yl)acetic acid
CAS Number1334179-85-9
PubChem CID56655929
IUPAC Name2-[4-[[bis[(1-tert-butyltriazol-4-yl)methyl]amino]methyl]triazol-1-yl]acetic acid
Molecular FormulaC19H30N10O2
Molecular Weight430.5
XLogP-2.6
Topological Polar Surface Area133
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count10
Heavy Atom Count31
Formal Charge0
Complexity573
SMILES
CC(C)(C)N1C=C(N=N1)CN(CC2=CN(N=N2)CC(=O)O)CC3=CN(N=N3)C(C)(C)C
InChI
InChI=1S/C19H30N10O2/c1-18(2,3)28-11-15(21-24-28)8-26(7-14-10-27(23-20-14)13-17(30)31)9-16-12-29(25-22-16)19(4,5)6/h10-12H,7-9,13H2,1-6H3,(H,30,31)
InChIKey
MGQYHUDOWOGSQI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-((Bis((1-tert-butyl-1H-1,2,3-triazol-4-yl)methyl)amino)methyl)-1H-1,2,3-triazol-1-yl)acetic acid
CAS: 1334179-85-9
CID: 56655929
Formula: C19H30N10O2
MW: 430.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight430.5
XLogP3-2.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count10
Exact Mass430.25532024
Monoisotopic Mass430.25532024
Topological Polar Surface Area133 Ų
Heavy Atom Count31
Formal Charge0
Complexity573
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

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