V022-6136 Screening compound: 3-[5-(2-fluorophenoxy)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[(pyridin-2-yl)methyl]propanamide

V022-6136 Screening compound: 3-[5-(2-fluorophenoxy)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[(pyridin-2-yl)methyl]propanamide
V022-6136 Screening compound: 3-[5-(2-fluorophenoxy)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[(pyridin-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6136
3-[5-(2-fluorophenoxy)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[(pyridin-2-yl)methyl]propanamide

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

V022-6136

Molecular Formula

C25H22F2N4O2 (C25 H22 F2 N4 O2)

Compound Name

3-[5-(2-fluorophenoxy)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[(pyridin-2-yl)methyl]propanamide

IUPAC name

3-[5-(2-fluorophenoxy)-1-(4-fluorophenyl)-3-methyl-1H-pyrazol-4-yl]-N-[(pyridin-2-yl)methyl]propanamide

SMILES

Cc(c(CCC(NCc1ncccc1)=O)c1Oc(cccc2)c2F)nn1-c(cc1)ccc1F

InChI

InChI=1S/C25H22F2N4O2/c1-17-21(13-14-24(32)29-16-19-6-4-5-15-28-19)25(33-23-8-3-2-7-22(23)27)31(30-17)20-11-9-18(26)10-12-20/h2-12,15H,13-14,16H2,1H3,(H,29,32)

InChI Key

KNXLXOKDEOHVSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19899503

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

448.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.984

Distribution Coefficient, logD

3.983

Water Solubility, LogSw

-4.25

Polar Surface Area

54.750

Acid Dissociation Constant (pKa)

12.67

Base Dissociation Constant (pKb)

4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

V022-6136 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V022-6136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-6136?
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What is the minimum amount of V022-6136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6136
  • 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 V022-6136 available by request