F345-0416 Screening compound: 4-[(benzylcarbamoyl)methyl]-N-cyclohexylpiperidine-1-carboxamide

F345-0416 Screening compound: 4-[(benzylcarbamoyl)methyl]-N-cyclohexylpiperidine-1-carboxamide
F345-0416 Screening compound: 4-[(benzylcarbamoyl)methyl]-N-cyclohexylpiperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F345-0416
4-[(benzylcarbamoyl)methyl]-N-cyclohexylpiperidine-1-carboxamide

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

F345-0416

Molecular Formula

C21H31N3O2 (C21 H31 N3 O2)

Compound Name

4-[(benzylcarbamoyl)methyl]-N-cyclohexylpiperidine-1-carboxamide

IUPAC name

4-[(benzylcarbamoyl)methyl]-N-cyclohexylpiperidine-1-carboxamide

SMILES

O=C(CC(CC1)CCN1C(NC1CCCCC1)=O)NCc1ccccc1

InChI

InChI=1S/C21H31N3O2/c25-20(22-16-18-7-3-1-4-8-18)15-17-11-13-24(14-12-17)21(26)23-19-9-5-2-6-10-19/h1,3-4,7-8,17,19H,2,5-6,9-16H2,(H,22,25)(H,23,26)

InChI Key

NQVJTORJDGZHGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27117219

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.515

Distribution Coefficient, logD

3.515

Water Solubility, LogSw

-3.56

Polar Surface Area

50.955

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

2.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

F345-0416 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

Anti-Inflammatory Library (24602 compounds)

CORONAVIRUS Library (20774 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • 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 F345-0416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F345-0416?
Check Price and Availability of F345-0416, 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 F345-0416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F345-0416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F345-0416
  • 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 F345-0416 available by request