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JNJ-7777120 (Standard)

CAT: 0804-HY-13508R-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-13508R-01Size:5 mg
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Description
JNJ-7777120 (Standard) is the analytical standard of JNJ-7777120. This product is intended for research and analytical applications. JNJ-7777120 is a potent and selective histamine H4 receptor antagonist (Ki=4.5 nM) . JNJ-7777120 effectively blocks histamine-induced migration of mouse tracheal mast cells from connective tissue to epithelial cells. JNJ-7777120 also significantly blocks neutrophil infiltration in a mouse Zymosan-induced peritonitis model. JNJ-7777120 has a good potential to study antipruritic and anti-inflammatory[1][2].
CAS Number
459168-41-3
UNSPSC
12352100
Target
Histamine Receptor; Reference Standards
Related Pathways
GPCR/G Protein; Immunology/Inflammation; Neuronal Signaling; Others
Field of Research
Inflammation/Immunology
Smiles
O=C(C(N1)=CC2=C1C=CC(Cl)=C2)N3CCN(C)CC3
Molecular Formula
C14H16ClN3O
Molecular Weight
277.75
References & Citations
[1]Thurmond RL, et al. A potent and selective histamine H4 receptor antagonist with anti-inflammatory properties. J Pharmacol Exp Ther. 2004 Apr;309 (1) :404-13. |[2]Ohsawa Y, et al. The antagonism of histamine H1 and H4 receptors ameliorates chronic allergic dermatitis via anti-pruritic and anti-inflammatory effects in NC/Nga mice. Allergy. 2012 Aug;67 (8) :1014-22.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Jnj-7777120

an H4 receptor antagonist; structure in first source

CAS Number459168-41-3
PubChem CID4908365
IUPAC Name(5-chloro-1H-indol-2-yl)-(4-methylpiperazin-1-yl)methanone
Molecular FormulaC14H16ClN3O
Molecular Weight277.75
XLogP2.3
Topological Polar Surface Area39.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count19
Formal Charge0
Complexity344
SMILES
CN1CCN(CC1)C(=O)C2=CC3=C(N2)C=CC(=C3)Cl
InChI
InChI=1S/C14H16ClN3O/c1-17-4-6-18(7-5-17)14(19)13-9-10-8-11(15)2-3-12(10)16-13/h2-3,8-9,16H,4-7H2,1H3
InChIKey
HUQJRYMLJBBEDO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Jnj-7777120
CAS: 459168-41-3
CID: 4908365
Formula: C14H16ClN3O
MW: 277.75
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight277.75
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass277.0981898
Monoisotopic Mass277.0981898
Topological Polar Surface Area39.3 Ų
Heavy Atom Count19
Formal Charge0
Complexity344
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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