F708-0073 Screening compound: N4-benzyl-4-methyl-N1-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide

F708-0073 Screening compound: N4-benzyl-4-methyl-N1-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide
F708-0073 Screening compound: N4-benzyl-4-methyl-N1-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F708-0073
N4-benzyl-4-methyl-N1-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide

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

F708-0073

Molecular Formula

C22H27N3O2S (C22 H27 N3 O2 S)

Compound Name

N4-benzyl-4-methyl-N1-[3-(methylsulfanyl)phenyl]piperidine-1,4-dicarboxamide

IUPAC name

N4-benzyl-4-methyl-N1-[3-(methylsulfanyl)phenyl]piperidine-14-dicarboxamide

SMILES

CC(CC1)(CCN1C(Nc1cccc(SC)c1)=O)C(NCc1ccccc1)=O

InChI

InChI=1S/C22H27N3O2S/c1-22(20(26)23-16-17-7-4-3-5-8-17)11-13-25(14-12-22)21(27)24-18-9-6-10-19(15-18)28-2/h3-10,15H,11-14,16H2,1-2H3,(H,23,26)(H,24,27)

InChI Key

UUFBHYNLBSMNOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27186612

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.513

Distribution Coefficient, logD

3.513

Water Solubility, LogSw

-3.82

Polar Surface Area

50.121

Acid Dissociation Constant (pKa)

12.31

Base Dissociation Constant (pKb)

-1.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

F708-0073 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PLpro Library (6343 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F708-0073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F708-0073?
Check Price and Availability of F708-0073, 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 F708-0073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F708-0073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F708-0073
  • 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 F708-0073 available by request