C794-1529 Screening compound: N-(4-bromo-2-fluorophenyl)-4-{[(3-chlorophenyl)methyl](methyl)amino}piperidine-1-carboxamide

C794-1529 Screening compound: N-(4-bromo-2-fluorophenyl)-4-{[(3-chlorophenyl)methyl](methyl)amino}piperidine-1-carboxamide
C794-1529 Screening compound: N-(4-bromo-2-fluorophenyl)-4-{[(3-chlorophenyl)methyl](methyl)amino}piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C794-1529
N-(4-bromo-2-fluorophenyl)-4-{[(3-chlorophenyl)methyl](methyl)amino}piperidine-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

C794-1529

Molecular Formula

C20H22BrClFN3O (C20 H22 BrClFN3 O)

Compound Name

N-(4-bromo-2-fluorophenyl)-4-{[(3-chlorophenyl)methyl](methyl)amino}piperidine-1-carboxamide

IUPAC name

N-(4-bromo-2-fluorophenyl)-4-{[(3-chlorophenyl)methyl](methyl)amino}piperidine-1-carboxamide

SMILES

CN(Cc1cc(Cl)ccc1)C(CC1)CCN1C(Nc(ccc(Br)c1)c1F)=O

InChI

InChI=1S/C20H22BrClFN3O/c1-25(13-14-3-2-4-16(22)11-14)17-7-9-26(10-8-17)20(27)24-19-6-5-15(21)12-18(19)23/h2-6,11-12,17H,7-10,13H2,1H3,(H,24,27)

InChI Key

SJTFGCCREWKEEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14796575

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.77

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.211

Distribution Coefficient, logD

3.562

Water Solubility, LogSw

-5.70

Polar Surface Area

27.605

Acid Dissociation Constant (pKa)

10.34

Base Dissociation Constant (pKb)

9.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

C794-1529 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C794-1529 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C794-1529?
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What is the minimum amount of C794-1529 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C794-1529
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C794-1529
  • 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 C794-1529 available by request