JNJ-40355003

CAT: 0804-HY-18013-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-18013-01Size:5 mg

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Description

JNJ-40355003 is a potent and selective atty acid amide hydrolase (FAAH) inhibitor[1].

CAS Number

1394894-41-7

UNSPSC

12352005

Target

FAAH

Type

Reference compound

Related Pathways

Metabolic Enzyme/Protease; Neuronal Signaling

Applications

Metabolism-sugar/lipid metabolism

Field of Research

Metabolic Disease

Assay Protocol

https://www.medchemexpress.com/jnj-40355003.html

Purity

99.81

Solubility

DMSO : 125 mg/mL (ultrasonic)

Smiles

O=C(N1CCN(CC2=CC(OC3=CC=C(Cl)C=C3)=CC=C2)CC1)NC4=CC=CN=C4

Molecular Formula

C23H23ClN4O2

Molecular Weight

422.91

References & Citations

[1]John M Keith, et al. Aryl Piperazinyl Ureas as Inhibitors of Fatty Acid Amide Hydrolase (FAAH) in Rat, Dog, and Primate. ACS Med Chem Lett. 2012 Aug 22;3 (10) :823-7.

Shipping Conditions

Room Temperature

Storage Conditions

-20°C, 3 years; 4°C, 2 years (Powder)

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Chemical Information

Jnj-40355003

CAS Number	1394894-41-7
PubChem CID	46863664
IUPAC Name	4-[[3-(4-chlorophenoxy)phenyl]methyl]-N-pyridin-3-ylpiperazine-1-carboxamide
Molecular Formula	C23H23ClN4O2
Molecular Weight	422.9
XLogP	3.5
Topological Polar Surface Area	57.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	30
Formal Charge	0
Complexity	535

SMILES

C1CN(CCN1CC2=CC(=CC=C2)OC3=CC=C(C=C3)Cl)C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C23H23ClN4O2/c24-19-6-8-21(9-7-19)30-22-5-1-3-18(15-22)17-27-11-13-28(14-12-27)23(29)26-20-4-2-10-25-16-20/h1-10,15-16H,11-14,17H2,(H,26,29)

InChIKey

CTYVKSQPMCSUOR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1394894-41-7

CID: 46863664

Formula: C23H23ClN4O2

MW: 422.9

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	422.9
XLogP3	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	422.1509537
Monoisotopic Mass	422.1509537
Topological Polar Surface Area	57.7 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	535
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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