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ART-CHEM-BB B025267

CAT: 0931-T9821-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T9821-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
381208-40-8
Target
Others
Related Pathways
Others
Purity
0.9919
Bioactivity
ART-CHEM-BB B025267 is the upregulator of utrophin production with EC50 of 1.8 μM and can be used in research on the treatment of Duchenne muscular dystrophy.
Smiles
CCN(CC)C1=CC=C(C=C1)N1N=C2C=C(C)C(N)=CC2=N1
Molecular Formula
C17H21N5
Molecular Weight
295.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-[4-(diethylamino)phenyl]-6-methyl-2H-1,2,3-benzotriazol-5-amine
CAS Number381208-40-8
PubChem CID886736
IUPAC Name2-[4-(diethylamino)phenyl]-6-methylbenzotriazol-5-amine
Molecular FormulaC17H21N5
Molecular Weight295.4
XLogP3.9
Topological Polar Surface Area60
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity351
SMILES
CCN(CC)C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)N)C
InChI
InChI=1S/C17H21N5/c1-4-21(5-2)13-6-8-14(9-7-13)22-19-16-10-12(3)15(18)11-17(16)20-22/h6-11H,4-5,18H2,1-3H3
InChIKey
WRIPKYOZKAJHRL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[4-(diethylamino)phenyl]-6-methyl-2H-1,2,3-benzotriazol-5-amine
CAS: 381208-40-8
CID: 886736
Formula: C17H21N5
MW: 295.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight295.4
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass295.17969569
Monoisotopic Mass295.17969569
Topological Polar Surface Area60 Ų
Heavy Atom Count22
Formal Charge0
Complexity351
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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