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162408-66-4 | [1,1'-Biphenyl]-4-carboxamide, 4'-acetyl-N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-
CAS No: 162408-66-4 Catalog No: AG001T3C MDL No:
Product Description
Catalog Number:
AG001T3C
Chemical Name:
[1,1'-Biphenyl]-4-carboxamide, 4'-acetyl-N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-
CAS Number:
162408-66-4
Molecular Formula:
C30H35N3O3
Molecular Weight:
485.6172
IUPAC Name:
4-(4-acetylphenyl)-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]benzamide
InChI:
InChI=1S/C30H35N3O3/c1-23(34)24-9-11-25(12-10-24)26-13-15-27(16-14-26)30(35)31-17-5-6-18-32-19-21-33(22-20-32)28-7-3-4-8-29(28)36-2/h3-4,7-16H,5-6,17-22H2,1-2H3,(H,31,35)
InChI Key:
JARNORYOPMINDY-UHFFFAOYSA-N
SMILES:
COc1ccccc1N1CCN(CC1)CCCCNC(=O)c1ccc(cc1)c1ccc(cc1)C(=O)C
UNII:
0Y0CM1A77L
Properties
Complexity:
677
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
485.268g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
485.628g/mol
Monoisotopic Mass:
485.268g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
61.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Literature
| Title | Journal |
|---|---|
| Why are most phospholipidosis inducers also hERG blockers? | Archives of toxicology 20171201 |
| Aromatic ring functionalization of benzolactam derivatives: new potent dopamine D3 receptor ligands. | Bioorganic & medicinal chemistry letters 20110501 |
| Sensitization to cocaine is inhibited after intra-accumbal GR103691 or rimonabant, but it is enhanced after co-infusion indicating functional interaction between accumbens D(3) and CB1 receptors. | Psychopharmacology 20110401 |
| Dopamine D3-like receptors modulate anxiety-like behavior and regulate GABAergic transmission in the rat lateral/basolateral amygdala. | Neuropsychopharmacology : official publication of the American College of Neuropsychopharmacology 20110401 |
| The brain cytoplasmic RNA BC1 regulates dopamine D2 receptor-mediated transmission in the striatum. | The Journal of neuroscience : the official journal of the Society for Neuroscience 20070815 |
| Dopamine D3 receptors regulate GABAA receptor function through a phospho-dependent endocytosis mechanism in nucleus accumbens. | The Journal of neuroscience : the official journal of the Society for Neuroscience 20060301 |
| Involvement of dopamine D3 and D4 receptors in the discriminative stimulus properties of cocaine in the rat. | Methods and findings in experimental and clinical pharmacology 20051101 |
| The role of QSAR in dopamine interactions. | Bioorganic & medicinal chemistry letters 20050415 |
| D(3) dopamine receptors are down-regulated in amphetamine sensitized rats and their putative antagonists modulate the locomotor sensitization to amphetamine. | Brain research 20030516 |
| D(3) receptor ligands modulate extracellular dopamine clearance in the nucleus accumbens. | Journal of neurochemistry 20020601 |
| Catecholamines in murine bone marrow derived mast cells. | Journal of neuroimmunology 20011001 |
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