6117-0161 Screening compound: 2-(piperidin-1-yl)ethyl 4-methoxybenzoate

6117-0161 Screening compound: 2-(piperidin-1-yl)ethyl 4-methoxybenzoate
6117-0161 Screening compound: 2-(piperidin-1-yl)ethyl 4-methoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6117-0161
2-(piperidin-1-yl)ethyl 4-methoxybenzoate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6117-0161

Molecular Formula

C15H21NO3 (C15 H21 NO3)

Compound Name

2-(piperidin-1-yl)ethyl 4-methoxybenzoate

IUPAC name

2-(piperidin-1-yl)ethyl 4-methoxybenzoate

SMILES

COc(cc1)ccc1C(OCCN1CCCCC1)=O

InChI

InChI=1S/C15H21NO3/c1-18-14-7-5-13(6-8-14)15(17)19-12-11-16-9-3-2-4-10-16/h5-8H,2-4,9-12H2,1H3

InChI Key

WFEWGRLNNWMDMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00438215

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

263.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.055

Distribution Coefficient, logD

2.197

Water Solubility, LogSw

-3.04

Polar Surface Area

32.541

Acid Dissociation Constant (pKa)

28.05

Base Dissociation Constant (pKb)

8.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

6117-0161 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

STING Agonist Library (5895 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Eye
  • Nervous system
  • Cancer
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • GPCR
  • Ion Channels
  • GPCR
  • Ion Channels
  • Others
  • Proteases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 6117-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6117-0161?
Check Price and Availability of 6117-0161, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6117-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6117-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6117-0161
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6117-0161 available by request