F708-0468 Screening compound: 4-methyl-N1-(3-methylbutyl)-N4-[(4-methylphenyl)methyl]piperidine-1,4-dicarboxamide

F708-0468 Screening compound: 4-methyl-N1-(3-methylbutyl)-N4-[(4-methylphenyl)methyl]piperidine-1,4-dicarboxamide
F708-0468 Screening compound: 4-methyl-N1-(3-methylbutyl)-N4-[(4-methylphenyl)methyl]piperidine-1,4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F708-0468
4-methyl-N1-(3-methylbutyl)-N4-[(4-methylphenyl)methyl]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

F708-0468

Molecular Formula

C21H33N3O2 (C21 H33 N3 O2)

Compound Name

4-methyl-N1-(3-methylbutyl)-N4-[(4-methylphenyl)methyl]piperidine-1,4-dicarboxamide

IUPAC name

4-methyl-N1-(3-methylbutyl)-N4-[(4-methylphenyl)methyl]piperidine-14-dicarboxamide

SMILES

CC(C)CCNC(N(CC1)CCC1(C)C(NCc1ccc(C)cc1)=O)=O

InChI

InChI=1S/C21H33N3O2/c1-16(2)9-12-22-20(26)24-13-10-21(4,11-14-24)19(25)23-15-18-7-5-17(3)6-8-18/h5-8,16H,9-15H2,1-4H3,(H,22,26)(H,23,25)

InChI Key

PVOQMUMXARYOPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27186751

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.612

Distribution Coefficient, logD

3.612

Water Solubility, LogSw

-3.55

Polar Surface Area

51.556

Acid Dissociation Constant (pKa)

12.31

Base Dissociation Constant (pKb)

1.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

F708-0468 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Immune system

References: we are preparing a list of scientific research reports with F708-0468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F708-0468?
Check Price and Availability of F708-0468, 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 F708-0468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F708-0468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F708-0468
  • 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 F708-0468 available by request