PD168,077

CAT: 0931-T19666-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-T19666-02Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

190383-31-4

Target

Others, Dopamine Receptor

Related Pathways

Neuroscience, GPCR/G Protein, Others

Bioactivity

PD168,077 is an agonist of dopamine D4 receptor. It has a facilitatory effect on memory consolidation.

Smiles

C(#N)C1=C(C=CC=C1)N2CCN(CNC(=O)C3=CC(C)=CC=C3)CC2

Molecular Formula

C20H22N4O

Molecular Weight

334.41

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

PD-168077

N-[[4-(2-cyanophenyl)-1-piperazinyl]methyl]-3-methylbenzamide is a member of piperazines.

CAS Number	190383-31-4
PubChem CID	3645619
IUPAC Name	N-[[4-(2-cyanophenyl)piperazin-1-yl]methyl]-3-methylbenzamide
Molecular Formula	C20H22N4O
Molecular Weight	334.4
XLogP	3
Topological Polar Surface Area	59.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	25
Formal Charge	0
Complexity	491

SMILES

CC1=CC(=CC=C1)C(=O)NCN2CCN(CC2)C3=CC=CC=C3C#N

InChI

InChI=1S/C20H22N4O/c1-16-5-4-7-17(13-16)20(25)22-15-23-9-11-24(12-10-23)19-8-3-2-6-18(19)14-21/h2-8,13H,9-12,15H2,1H3,(H,22,25)

InChIKey

DNULYRGWTFLJQL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 190383-31-4

CID: 3645619

Formula: C20H22N4O

MW: 334.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	334.4
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	334.17936134
Monoisotopic Mass	334.17936134
Topological Polar Surface Area	59.4 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	491
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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T71436-01	D561-0775
T31107-01	CS-0777
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Alternative Products

Catalog	Name
GTR19203534-01	PD168,077
B5657-10	MKT 077
BUP04189-01	MKT-077
GTR19273716-01	OXF-077
HY-120813-01	ARN 077
KVB30461-01	ML 077
MBS5814494	ML-077
HY-105060	TA 077

PD168,077

Chemical Information

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