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Leucyl-phenylalanine amide

CAT: 0804-HY-137462Size: 1 EachDry Ice: NoHazardous: No
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Description
Leucyl-phenylalanine amide (L-Leucyl-L-phenylalaninamide) is a dipeptide analog. Leucyl-phenylalanine amide is a ligand of SP1-7 with a Ki value of 10.2 nM. Leucyl-phenylalanine amide shows no binding activity to human NK-1 or NK-3 receptors[1].
CAS Number
38678-60-3
Product Name Alternative
L-Leucyl-L-phenylalaninamide
UNSPSC
12352005
Target
Neurokinin Receptor
Related Pathways
GPCR/G Protein; Neuronal Signaling
Field of Research
Inflammation/Immunology; Neurological Disease
Smiles
NC([C@@H](NC([C@@H](N)CC(C)C)=O)CC1=CC=CC=C1)=O
Molecular Formula
C15H23N3O2
Molecular Weight
277.36
References & Citations
[1]Fransson R, et al. Discovery of dipeptides with high affinity to the specific binding site for substance P1-7. J Med Chem. 2010 Mar 25;53 (6) :2383-9.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Leucyl-phenylalanine amide
CAS Number38678-60-3
PubChem CID3082491
IUPAC Name(2S)-2-amino-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-4-methylpentanamide
Molecular FormulaC15H23N3O2
Molecular Weight277.36
XLogP0.5
Topological Polar Surface Area98.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count20
Formal Charge0
Complexity325
SMILES
CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N)N
InChI
InChI=1S/C15H23N3O2/c1-10(2)8-12(16)15(20)18-13(14(17)19)9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9,16H2,1-2H3,(H2,17,19)(H,18,20)/t12-,13-/m0/s1
InChIKey
HVNQCDIUFGAINF-STQMWFEESA-N
Chemical Structure
2D Structure
2D structure of Leucyl-phenylalanine amide
CAS: 38678-60-3
CID: 3082491
Formula: C15H23N3O2
MW: 277.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight277.36
XLogP30.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass277.17902698
Monoisotopic Mass277.17902698
Topological Polar Surface Area98.2 Ų
Heavy Atom Count20
Formal Charge0
Complexity325
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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