5979-0150 Screening compound: 3-(4-benzylpiperidine-1-carbonyl)-1-[(5-bromo-2-methoxyphenyl)methyl]piperidine

5979-0150 Screening compound: 3-(4-benzylpiperidine-1-carbonyl)-1-[(5-bromo-2-methoxyphenyl)methyl]piperidine
5979-0150 Screening compound: 3-(4-benzylpiperidine-1-carbonyl)-1-[(5-bromo-2-methoxyphenyl)methyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5979-0150
3-(4-benzylpiperidine-1-carbonyl)-1-[(5-bromo-2-methoxyphenyl)methyl]piperidine

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

5979-0150

Molecular Formula

C26H33BrN2O2 (C26 H33 BrN2 O2)

Compound Name

3-(4-benzylpiperidine-1-carbonyl)-1-[(5-bromo-2-methoxyphenyl)methyl]piperidine

IUPAC name

3-(4-benzylpiperidine-1-carbonyl)-1-[(5-bromo-2-methoxyphenyl)methyl]piperidine

SMILES

COc(cc1)c(CN(CCC2)CC2C(N2CCC(Cc3ccccc3)CC2)=O)cc1Br

InChI

InChI=1S/C26H33BrN2O2/c1-31-25-10-9-24(27)17-23(25)19-28-13-5-8-22(18-28)26(30)29-14-11-21(12-15-29)16-20-6-3-2-4-7-20/h2-4,6-7,9-10,17,21-22H,5,8,11-16,18-19H2,1H3/t22-/m0/s1

InChI Key

DZMGSZPDWIUFGW-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD03615718

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

485.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.291

Distribution Coefficient, logD

4.513

Water Solubility, LogSw

-5.36

Polar Surface Area

27.912

Acid Dissociation Constant (pKa)

22.70

Base Dissociation Constant (pKb)

8.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

5979-0150 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

GPCR Targeted Library (31838 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5979-0150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5979-0150?
Check Price and Availability of 5979-0150, 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 5979-0150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5979-0150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5979-0150
  • 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 5979-0150 available by request