F033-2873 Screening compound: N-[(2-chlorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-1,2,3,6-tetrahydropyridine-4-carboxamide

F033-2873 Screening compound: N-[(2-chlorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-1,2,3,6-tetrahydropyridine-4-carboxamide
F033-2873 Screening compound: N-[(2-chlorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-1,2,3,6-tetrahydropyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F033-2873
N-[(2-chlorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-1,2,3,6-tetrahydropyridine-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

F033-2873

Molecular Formula

C20H20ClFN2O (C20 H20 ClFN2 O)

Compound Name

N-[(2-chlorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-1,2,3,6-tetrahydropyridine-4-carboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-1-[(3-fluorophenyl)methyl]-1236-tetrahydropyridine-4-carboxamide

SMILES

O=C(C1=CCN(Cc2cc(F)ccc2)CC1)NCc(cccc1)c1Cl

InChI

InChI=1S/C20H20ClFN2O/c21-19-7-2-1-5-17(19)13-23-20(25)16-8-10-24(11-9-16)14-15-4-3-6-18(22)12-15/h1-8,12H,9-11,13-14H2,(H,23,25)

InChI Key

SRUUHTDQZPMDGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27095915

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.84

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.211

Distribution Coefficient, logD

1.375

Water Solubility, LogSw

-4.43

Polar Surface Area

28.384

Acid Dissociation Constant (pKa)

11.46

Base Dissociation Constant (pKb)

10.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F033-2873 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with F033-2873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F033-2873?
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What is the minimum amount of F033-2873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F033-2873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F033-2873
  • 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 F033-2873 available by request