C798-1304 Screening compound: N-[(4-fluorophenyl)methyl]-1-({1-[(4-methylphenyl)methyl]-1H-indol-2-yl}methyl)piperidine-4-carboxamide

C798-1304 Screening compound: N-[(4-fluorophenyl)methyl]-1-({1-[(4-methylphenyl)methyl]-1H-indol-2-yl}methyl)piperidine-4-carboxamide
C798-1304 Screening compound: N-[(4-fluorophenyl)methyl]-1-({1-[(4-methylphenyl)methyl]-1H-indol-2-yl}methyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C798-1304
N-[(4-fluorophenyl)methyl]-1-({1-[(4-methylphenyl)methyl]-1H-indol-2-yl}methyl)piperidine-4-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

C798-1304

Molecular Formula

C30H32FN3O (C30 H32 FN3 O)

Compound Name

N-[(4-fluorophenyl)methyl]-1-({1-[(4-methylphenyl)methyl]-1H-indol-2-yl}methyl)piperidine-4-carboxamide

IUPAC name

N-[(4-fluorophenyl)methyl]-1-({1-[(4-methylphenyl)methyl]-1H-indol-2-yl}methyl)piperidine-4-carboxamide

SMILES

Cc1ccc(Cn(c(CN(CC2)CCC2C(NCc(cc2)ccc2F)=O)c2)c3c2cccc3)cc1

InChI

InChI=1S/C30H32FN3O/c1-22-6-8-24(9-7-22)20-34-28(18-26-4-2-3-5-29(26)34)21-33-16-14-25(15-17-33)30(35)32-19-23-10-12-27(31)13-11-23/h2-13,18,25H,14-17,19-21H2,1H3,(H,32,35)

InChI Key

PVSVPUPIKSNCBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26966417

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.6

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.217

Distribution Coefficient, logD

3.119

Water Solubility, LogSw

-5.62

Polar Surface Area

29.319

Acid Dissociation Constant (pKa)

12.14

Base Dissociation Constant (pKb)

9.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

C798-1304 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

CNS Targets (44014 compounds)

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)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C798-1304 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C798-1304?
Check Price and Availability of C798-1304, 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 C798-1304 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C798-1304
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C798-1304
  • 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 C798-1304 available by request