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UPGL00004

CAT: 0013-GTR19202951-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202951-02Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
UPGL00004 is a potent and selective glutaminase C (GAC) inhibitor, demonstrating high affinity with a Kd of 27 nM and inhibiting GAC activity with an IC50 of 29 nM. It effectively suppresses the proliferation of aggressive triple-negative breast cancer cells in vitro, making it a valuable tool for studying cancer metabolism and therapeutic targeting.
CAS Number
1890169-95-5
Product Name Alternative
Glutaminase C, UPGL 00004, UPGL00004, UPGL-00004
Field of Research
Protein Biochemistry
Purity
97.44% (May vary between batches)
Solubility
DMSO:112.5 mg/mL (210.41 mM)
Smiles
O=C (Cc1ccccc1) Nc1nnc (NC2CCN (CC2) c2nnc (NC (=O) Cc3ccccc3) s2) s1
Molecular Formula
C25H26N8O2S2
Molecular Weight
534.66
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-phenyl-N-(5-(4-((5-(2-phenylacetamido)-1,3,4-thiadiazol-2-yl)amino)piperidin-1-yl)-1,3,4-thiadiazol-2-yl)acetamide
CAS Number1890169-95-5
PubChem CID121256411
IUPAC Name2-phenyl-N-[5-[[1-[5-[(2-phenylacetyl)amino]-1,3,4-thiadiazol-2-yl]piperidin-4-yl]amino]-1,3,4-thiadiazol-2-yl]acetamide
Molecular FormulaC25H26N8O2S2
Molecular Weight534.7
XLogP4
Topological Polar Surface Area182
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Heavy Atom Count37
Formal Charge0
Complexity744
SMILES
C1CN(CCC1NC2=NN=C(S2)NC(=O)CC3=CC=CC=C3)C4=NN=C(S4)NC(=O)CC5=CC=CC=C5
InChI
InChI=1S/C25H26N8O2S2/c34-20(15-17-7-3-1-4-8-17)27-23-30-29-22(36-23)26-19-11-13-33(14-12-19)25-32-31-24(37-25)28-21(35)16-18-9-5-2-6-10-18/h1-10,19H,11-16H2,(H,26,29)(H,27,30,34)(H,28,31,35)
InChIKey
MRYCNTHLPRENBA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-phenyl-N-(5-(4-((5-(2-phenylacetamido)-1,3,4-thiadiazol-2-yl)amino)piperidin-1-yl)-1,3,4-thiadiazol-2-yl)acetamide
CAS: 1890169-95-5
CID: 121256411
Formula: C25H26N8O2S2
MW: 534.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight534.7
XLogP34
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Exact Mass534.16201445
Monoisotopic Mass534.16201445
Topological Polar Surface Area182 Ų
Heavy Atom Count37
Formal Charge0
Complexity744
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

Alternative Products

CatalogName
QAD16995-01UPGL00004
A19047-25UPGL00004 25mg
A19047-5UPGL00004 5mg
A19047-100UPGL00004 100mg
A19047-10UPGL00004 10mg
A19047-50UPGL00004 50mg
A19047-10mM-DUPGL00004 10mM * 1mL in DMSO

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