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KLH45

CAT: 0013-GTR19200134-01Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19200134-01Size:1 ml x 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
KLH45 is a potent and selective small molecule inhibitor of the triglyceride hydrolase DDHD2 (SPG54), exhibiting an IC50 of 1.3 nM. This compound is a valuable chemical probe for investigating lipid metabolism and the pathogenesis of hereditary spastic paraplegia in both cellular and animal model studies.
CAS Number
1632236-44-2
Product Name Alternative
DDHD2, KLH 45, KLH45, KLH-45
Field of Research
Metabolism Research
Purity
99.61% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:5 mg/mL (10.91 mM) ; DMSO:162 mg/mL (353.34 mM)
Smiles
FC (F) (F) Oc1ccc (cc1) -c1cnn (n1) C (=O) N (CCc1ccccc1) C1CCCCC1
Molecular Formula
C24H25F3N4O2
Molecular Weight
458.48
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-Cyclohexyl-N-phenethyl-4-(4-(trifluoromethoxy)phenyl)-2H-1,2,3-triazole-2-carboxamide
CAS Number1632236-44-2
PubChem CID126970670
IUPAC NameN-cyclohexyl-N-(2-phenylethyl)-4-[4-(trifluoromethoxy)phenyl]triazole-2-carboxamide
Molecular FormulaC24H25F3N4O2
Molecular Weight458.5
XLogP6.7
Topological Polar Surface Area60.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity615
SMILES
C1CCC(CC1)N(CCC2=CC=CC=C2)C(=O)N3N=CC(=N3)C4=CC=C(C=C4)OC(F)(F)F
InChI
InChI=1S/C24H25F3N4O2/c25-24(26,27)33-21-13-11-19(12-14-21)22-17-28-31(29-22)23(32)30(20-9-5-2-6-10-20)16-15-18-7-3-1-4-8-18/h1,3-4,7-8,11-14,17,20H,2,5-6,9-10,15-16H2
InChIKey
FYOYNRLSBYWAHL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Cyclohexyl-N-phenethyl-4-(4-(trifluoromethoxy)phenyl)-2H-1,2,3-triazole-2-carboxamide
CAS: 1632236-44-2
CID: 126970670
Formula: C24H25F3N4O2
MW: 458.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight458.5
XLogP36.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass458.19296054
Monoisotopic Mass458.19296054
Topological Polar Surface Area60.3 Ų
Heavy Atom Count33
Formal Charge0
Complexity615
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
BUP10609-01KLH45
A22148-100KLH45 100mg
A22148-25KLH45 25mg
A22148-50KLH45 50mg
A22148-10KLH45 10mg
A22148-5KLH45 5mg
A22148-10mM-DKLH45 10mM * 1mL in DMSO

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