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USP30 inhibitor 18

CAT: 0931-T36682-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T36682-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2242582-40-5
Target
DUB, Mitophagy
Related Pathways
Autophagy, DNA Damage/DNA Repair, Cell Cycle/Checkpoint, Ubiquitination
Purity
0.9985
Bioactivity
USP30 inhibitor 18 is a selective inhibitor of USP30 (IC50 = 0.02 μM) . USP30 inhibitor 18 is able to accelerate mitophagy and increase protein ubiquitination.
Smiles
CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccc(F)cc2)cc1
Molecular Formula
C26H28FN3O4S
Molecular Weight
497.58
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

USP30 inhibitor 18
CAS Number2242582-40-5
PubChem CID142474792
IUPAC NameN-[(2S)-1-[4-(tert-butylsulfamoyl)anilino]-1-oxo-3-phenylpropan-2-yl]-4-fluorobenzamide
Molecular FormulaC26H28FN3O4S
Molecular Weight497.6
XLogP4.1
Topological Polar Surface Area113
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count35
Formal Charge0
Complexity801
SMILES
CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)F
InChI
InChI=1S/C26H28FN3O4S/c1-26(2,3)30-35(33,34)22-15-13-21(14-16-22)28-25(32)23(17-18-7-5-4-6-8-18)29-24(31)19-9-11-20(27)12-10-19/h4-16,23,30H,17H2,1-3H3,(H,28,32)(H,29,31)/t23-/m0/s1
InChIKey
NRHPFMQPXSSELC-QHCPKHFHSA-N
Chemical Structure
2D Structure
2D structure of USP30 inhibitor 18
CAS: 2242582-40-5
CID: 142474792
Formula: C26H28FN3O4S
MW: 497.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight497.6
XLogP34.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass497.17845572
Monoisotopic Mass497.17845572
Topological Polar Surface Area113 Ų
Heavy Atom Count35
Formal Charge0
Complexity801
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes