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MK-0916

CAT: 0013-GTR19193520-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19193520-01Size:25 mg
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Description
MK-0916 is a selective inhibitor of 11β-hydroxysteroid dehydrogenase type 1 (11β-HSD1) . This research compound is used to investigate therapeutic strategies for type 2 diabetes, metabolic syndrome, and obesity-related disorders in both cellular and animal model studies.
CAS Number
633317-53-0
Smiles
F[C@H]1C[C@@] (C1) (c1nnc (C2CC2) n1C1CC1) c1ccc (Cl) cc1
Molecular Formula
C18H19ClFN3
Molecular Weight
331.82
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-(1-(4-Chlorophenyl)-3-fluorocyclobutyl)-4,5-dicyclopropyl-1,2,4-triazole
CAS Number633317-53-0
PubChem CID9797661
IUPAC Name3-[1-(4-chlorophenyl)-3-fluorocyclobutyl]-4,5-dicyclopropyl-1,2,4-triazole
Molecular FormulaC18H19ClFN3
Molecular Weight331.8
XLogP3.7
Topological Polar Surface Area30.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity453
SMILES
C1CC1C2=NN=C(N2C3CC3)C4(CC(C4)F)C5=CC=C(C=C5)Cl
InChI
InChI=1S/C18H19ClFN3/c19-13-5-3-12(4-6-13)18(9-14(20)10-18)17-22-21-16(11-1-2-11)23(17)15-7-8-15/h3-6,11,14-15H,1-2,7-10H2
InChIKey
OGYZYOKAXYFLIU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(1-(4-Chlorophenyl)-3-fluorocyclobutyl)-4,5-dicyclopropyl-1,2,4-triazole
CAS: 633317-53-0
CID: 9797661
Formula: C18H19ClFN3
MW: 331.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight331.8
XLogP33.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass331.1251535
Monoisotopic Mass331.1251535
Topological Polar Surface Area30.7 Ų
Heavy Atom Count23
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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