ChemicalBook CAS DataBase List 1052147-86-0

1052147-86-0

Name	N-(4-cyanophenylmethyl)-4-(2-diphenyl)-1-piperazinehexanamide
CAS	1052147-86-0
Molecular Formula	C30H34N4O
MDL Number	MFCD22690843
Molecular Weight	466.62
MOL File	1052147-86-0.mol

Chemical Properties

Boiling point	714.8±60.0 °C(Predicted)
density	1.17±0.1 g/cm3(Predicted)
storage temp.	2-8°C
solubility	DMSO:100.0(Max Conc. mg/mL);214.3(Max Conc. mM) Ethanol:50.0(Max Conc. mg/mL);107.15(Max Conc. mM)
form	solid
pka	15.39±0.46(Predicted)
color	clear white to light brown
InChIKey	BQEDZLDNNBDKDS-UHFFFAOYSA-N
SMILES	O=C(NCC1=CC=C(C#N)C=C1)CCCCCN2CCN(C3=CC=CC=C3C4=CC=CC=C4)CC2

Safety Data

WGK Germany	WGK 3
Storage Class	11 - Combustible Solids

Hazard Information

Uses

LP-211 is a brain penetrant selective agonist for the serotonin 5-HT7 receptor used in pharmacological studies which showed that it underwent metabolic breakdown to RA-7 and showed pharmacological activities such as induced hypothermia in mice and showed optimal pharmacokinetics in rats.LP-211 is also a drug analogue of piperazinehexanamide exhibiting 5-HT7 receptor affinity.

Biochem/physiol Actions

LP-211 is a brain penetrant selective agonist for the serotonin 5-HT7 receptor with a Ki value of 0.58 nM at rat cloned 5-HT7 receptors, and >300-fold selectivity over the 5-HT1A receptor. The 5-HT7 receptor is involved in a variety of central nervous system functions including circadian rhythm, sleep, thermoregulation, nociception, and memory, and appears to be involved in cognitive disorders, anxiety, and depression. LP-211 has been used as a selective 5-HT7 receptor agonist in multiple models including studies as a potential therapeutic agent in models of Rett syndrome and Fragile X Syndrome.

in vivo

LP-211 (10 mg/kg, i.p.) rapidly reaches the systemic circulation in the mouse, with mean C_max of 0.76 ± 0.32 μg/mL at 30 min^[1]. LP-211 (0.003-0.3 mg/kg, i.p.) significantly increases the micturition volume in a dose-dependent manner, and causes significant increases in voiding efficiency in spinal cord-injured (SCI) rats, and such effects can be completely reversed by SB-269970^[2]. LP-211 (0.25 and 0.50 mg/kg i.p.) improves consolidation of chamber-shape memory in rats, resulting in significant novelty-induced hyperactivity and recognition^[3].

IC 50

5-HT₇ Receptor: 0.58 nM (Ki); 5-HT_1A Receptor: 188 nM (Ki); D₂ Receptor: 142 nM (Ki)

storage

Store at -20°C

Spectrum Detail

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