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TCH-165

CAT: 0931-T17011-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T17011-04Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1446350-60-2
Target
Proteasome
Related Pathways
Ubiquitination, Proteases/Proteasome
Purity
0.9875
Bioactivity
TCH-165 is a small molecule modulator of proteasome assembly, resulting in an increase in 20S levels. The increase in the level of free 20S corresponds to enhanced proteolysis of IDPs.
Smiles
CCOC(=O)[C@@]1(N=C(N(Cc2ccccc2)[C@@H]1c1ccc(NCc2ccccc2)cc1)c1ccc(OC)cc1)c1ccccc1
Molecular Formula
C39H37N3O3
Molecular Weight
595.73
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

rel-Ethyl (4R,5R)-1-benzyl-5-(4-(benzylamino)phenyl)-2-(4-methoxyphenyl)-4-phenyl-4,5-dihydro-1H-imidazole-4-carboxylate
CAS Number1446350-60-2
PubChem CID71762768
IUPAC Nameethyl (4R,5R)-3-benzyl-4-[4-(benzylamino)phenyl]-2-(4-methoxyphenyl)-5-phenyl-4H-imidazole-5-carboxylate
Molecular FormulaC39H37N3O3
Molecular Weight595.7
XLogP7.5
Topological Polar Surface Area63.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count12
Heavy Atom Count45
Formal Charge0
Complexity937
SMILES
CCOC(=O)[C@]1([C@H](N(C(=N1)C2=CC=C(C=C2)OC)CC3=CC=CC=C3)C4=CC=C(C=C4)NCC5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C39H37N3O3/c1-3-45-38(43)39(33-17-11-6-12-18-33)36(31-19-23-34(24-20-31)40-27-29-13-7-4-8-14-29)42(28-30-15-9-5-10-16-30)37(41-39)32-21-25-35(44-2)26-22-32/h4-26,36,40H,3,27-28H2,1-2H3/t36-,39-/m1/s1
InChIKey
XXDLWRCUPASJGY-AEGYFVCZSA-N
Chemical Structure
2D Structure
2D structure of rel-Ethyl (4R,5R)-1-benzyl-5-(4-(benzylamino)phenyl)-2-(4-methoxyphenyl)-4-phenyl-4,5-dihydro-1H-imidazole-4-carboxylate
CAS: 1446350-60-2
CID: 71762768
Formula: C39H37N3O3
MW: 595.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight595.7
XLogP37.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count12
Exact Mass595.28349205
Monoisotopic Mass595.28349205
Topological Polar Surface Area63.2 Ų
Heavy Atom Count45
Formal Charge0
Complexity937
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

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