CAS 118306-89-1 | 4-PIPERAZIN-1-YL-QUINOLINE | CAS Number 118306-89-1

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118306-89-1 | 4-PIPERAZIN-1-YL-QUINOLINE

CAS No: 118306-89-1 Catalog No: AG008ZB1 MDL No:MFCD02179800

Product Description

Catalog Number:

AG008ZB1

Chemical Name:

4-PIPERAZIN-1-YL-QUINOLINE

CAS Number:

118306-89-1

Molecular Formula:

C13H15N3

Molecular Weight:

213.2783

MDL Number:

MFCD02179800

IUPAC Name:

4-piperazin-1-ylquinoline

InChI:

InChI=1S/C13H15N3/c1-2-4-12-11(3-1)13(5-6-15-12)16-9-7-14-8-10-16/h1-6,14H,7-10H2

InChI Key:

CGSWRHKBLLDUHO-UHFFFAOYSA-N

SMILES:

N1CCN(CC1)c1ccnc2c1cccc2

Properties

Complexity:

225

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

213.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

213.284g/mol

Monoisotopic Mass:

213.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

28.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4

Literature

Title	Journal
Discovery of β2 Adrenergic Receptor Ligands Using Biosensor Fragment Screening of Tagged Wild-Type Receptor.	ACS medicinal chemistry letters 20131010
Design and synthesis of anti-breast cancer agents from 4-piperazinylquinoline: a hybrid pharmacophore approach.	Bioorganic & medicinal chemistry 20100215
Memories are made of this (perhaps): a review of serotonin 5-HT(6) receptor ligands and their biological functions.	Current topics in medicinal chemistry 20020601