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Butabindide

CAT: 0931-T60700-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T60700-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
175553-48-7
Target
Others, Serine Protease
Related Pathways
Others, Proteases/Proteasome
Bioactivity
Butabindide (UCL-1397) is a potent, selective inhibitor of tripeptidyl peptidase II (TPP II), with Ki values of 10 μM and 7 nM for TPP I and TPP II, respectively, inhibiting TPP II to protect CCK-8 against inactivation [1] [2].
Smiles
C([C@H](CC)N)(=O)N1C=2C(C[C@H]1C(NCCCC)=O)=CC=CC2
Molecular Formula
C17H25N3O2
Molecular Weight
303.4
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Butabindide
CAS Number175553-48-7
PubChem CID9817923
IUPAC Name(2S)-1-[(2S)-2-aminobutanoyl]-N-butyl-2,3-dihydroindole-2-carboxamide
Molecular FormulaC17H25N3O2
Molecular Weight303.4
XLogP2
Topological Polar Surface Area75.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity399
SMILES
CCCCNC(=O)[C@@H]1CC2=CC=CC=C2N1C(=O)[C@H](CC)N
InChI
InChI=1S/C17H25N3O2/c1-3-5-10-19-16(21)15-11-12-8-6-7-9-14(12)20(15)17(22)13(18)4-2/h6-9,13,15H,3-5,10-11,18H2,1-2H3,(H,19,21)/t13-,15-/m0/s1
InChIKey
HAQIRIMIVLFYIX-ZFWWWQNUSA-N
Chemical Structure
2D Structure
2D structure of Butabindide
CAS: 175553-48-7
CID: 9817923
Formula: C17H25N3O2
MW: 303.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight303.4
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass303.19467705
Monoisotopic Mass303.19467705
Topological Polar Surface Area75.4 Ų
Heavy Atom Count22
Formal Charge0
Complexity399
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-150070Butabindide
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A16029-1Butabindide oxalate 1mg
A16029-5Butabindide oxalate 5mg
A16029-50Butabindide oxalate 50mg
A16029-10Butabindide oxalate 10mg

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