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Cathepsin X-IN-1

CAT: 1410-M35476-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Cathepsin X-IN-1 (compound 25) is a potent Cathepsin X inhibitor (IC50 = 7.13 μM) that reduces PC-3 cell migration with low cytotoxicity .
CAS Number
2418577-51-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
315.35
Molecular Formula
C15H13N3O3S
Notes
Research use only, not for human use.
Receptor
Cysteine Protease

Chemical Information

Cathepsin X-IN-1
CAS Number2418577-51-0
PubChem CID162654727
IUPAC Name2-[2-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanylimidazol-1-yl]acetonitrile
Molecular FormulaC15H13N3O3S
Molecular Weight315.3
XLogP1.9
Topological Polar Surface Area102
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge0
Complexity453
SMILES
C1COC2=C(O1)C=CC(=C2)C(=O)CSC3=NC=CN3CC#N
InChI
InChI=1S/C15H13N3O3S/c16-3-5-18-6-4-17-15(18)22-10-12(19)11-1-2-13-14(9-11)21-8-7-20-13/h1-2,4,6,9H,5,7-8,10H2
InChIKey
PTNGAXZNCFUKJN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cathepsin X-IN-1
CAS: 2418577-51-0
CID: 162654727
Formula: C15H13N3O3S
MW: 315.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.3
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass315.06776246
Monoisotopic Mass315.06776246
Topological Polar Surface Area102 Ų
Heavy Atom Count22
Formal Charge0
Complexity453
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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Alternative Products

CatalogName
BUP05905-01Cathepsin X-IN-1
218083-01CTSZ (Cathepsin Z, Cathepsin X, Cathepsin P)
C2097-83Cathepsin Z (CTSZ, Cathepsin P, Cathepsin X)
034354CTSZ, NT (CTSZ, Cathepsin Z, Cathepsin P, Cathepsin X)
GTR10454189Mouse Cathepsin X ELISA
GTR10464461Human Cathepsin X ELISA
GTR10473480Monkey Cathepsin X ELISA
GTR10454615Porcine Cathepsin X ELISA
GTR10419702Canine Cathepsin X ELISA
GTR10476883Chicken Cathepsin X ELISA

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