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FAUC-312

CAT: 0804-HY-121740Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-121740Size:1 Each
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
FAUC-312, a tetrahydropyrimidine, is a strong and highly selective dopamine D4 receptor partial agonist (Ki=1.5 nM) [1].
CAS Number
562104-72-7
UNSPSC
12352005
Target
Dopamine Receptor
Type
Reference compound
Related Pathways
GPCR/G Protein; Neuronal Signaling
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/fauc-312.html
Smiles
C1(C2=CC=CC=C2)=NCC[C@H](N1)CN3CCN(CC3)C4=CC=CC=C4
Molecular Formula
C21H26N4
Molecular Weight
334.46
References & Citations
[1]Jürgen Einsiedel, et al. Cyclic amidines as benzamide bioisosteres: EPC synthesis and SAR studies leading to the selective dopamine D4 receptor agonist FAUC 312. Bioorg Med Chem Lett. 2003 Mar 10;13 (5) :851-4.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
D1 Receptor; D2 Receptor; D3 Receptor; D4 Receptor

Chemical Information

(+)-(6S)-3,4,5,6-Tetrahydro-2-phenyl-6-((4-phenyl-1-piperazinyl)methyl)pyrimidine
CAS Number562104-72-7
PubChem CID10359539
IUPAC Name(6S)-2-phenyl-6-[(4-phenylpiperazin-1-yl)methyl]-1,4,5,6-tetrahydropyrimidine
Molecular FormulaC21H26N4
Molecular Weight334.5
XLogP2.9
Topological Polar Surface Area30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity429
SMILES
C1CN=C(N[C@@H]1CN2CCN(CC2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C21H26N4/c1-3-7-18(8-4-1)21-22-12-11-19(23-21)17-24-13-15-25(16-14-24)20-9-5-2-6-10-20/h1-10,19H,11-17H2,(H,22,23)/t19-/m0/s1
InChIKey
BJWYIHWMKMZYRS-IBGZPJMESA-N
Chemical Structure
2D Structure
2D structure of (+)-(6S)-3,4,5,6-Tetrahydro-2-phenyl-6-((4-phenyl-1-piperazinyl)methyl)pyrimidine
CAS: 562104-72-7
CID: 10359539
Formula: C21H26N4
MW: 334.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight334.5
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass334.21574685
Monoisotopic Mass334.21574685
Topological Polar Surface Area30.9 Ų
Heavy Atom Count25
Formal Charge0
Complexity429
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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