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PF-3845

CAT: 0013-GTR19164341-09Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19164341-09Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
PF-3845 is a potent, selective and irreversible FAAH inhibitor with Ki of 230 nM, showing negligible activity against FAAH2.
CAS Number
1196109-52-0
Product Name Alternative
PF3845 | PF-3845 | PF 3845
Purity
>98% (HPLC)
Solubility
DMSO:45.7 mg/mL (100 mM) ; Ethanol:22.8 mg/mL (50 mM)
Smiles
O=C (N1CCC (CC2=CC=CC (OC3=NC=C (C (F) (F) F) C=C3) =C2) CC1) NC4=CC=CN=C4
Molecular Formula
C??H??F?N?O?
Molecular Weight
456.46
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
N-3-Pyridinyl-4-[[3-[[5- (trifluoromethyl) -2-pyridinyl]oxy]phenyl]methyl]-1-piperidinecarboxamide

Chemical Information

N-3-Pyridinyl-4-((3-((5-(trifluoromethyl)-2-pyridinyl)oxy)phenyl)methyl)-1-piperidinecarboxamide

N-(3-pyridinyl)-4-[[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methyl]-1-piperidinecarboxamide is a member of piperidines.

CAS Number1196109-52-0
PubChem CID25154867
IUPAC NameN-pyridin-3-yl-4-[[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]methyl]piperidine-1-carboxamide
Molecular FormulaC24H23F3N4O2
Molecular Weight456.5
XLogP4.4
Topological Polar Surface Area67.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count33
Formal Charge0
Complexity627
SMILES
C1CN(CCC1CC2=CC(=CC=C2)OC3=NC=C(C=C3)C(F)(F)F)C(=O)NC4=CN=CC=C4
InChI
InChI=1S/C24H23F3N4O2/c25-24(26,27)19-6-7-22(29-15-19)33-21-5-1-3-18(14-21)13-17-8-11-31(12-9-17)23(32)30-20-4-2-10-28-16-20/h1-7,10,14-17H,8-9,11-13H2,(H,30,32)
InChIKey
NBOJHRYUGLRASX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-3-Pyridinyl-4-((3-((5-(trifluoromethyl)-2-pyridinyl)oxy)phenyl)methyl)-1-piperidinecarboxamide
CAS: 1196109-52-0
CID: 25154867
Formula: C24H23F3N4O2
MW: 456.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight456.5
XLogP34.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass456.17731048
Monoisotopic Mass456.17731048
Topological Polar Surface Area67.4 Ų
Heavy Atom Count33
Formal Charge0
Complexity627
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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