D399-2433 Screening compound: 4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]methyl}-2,6-dimethoxyphenol

D399-2433 Screening compound: 4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]methyl}-2,6-dimethoxyphenol
D399-2433 Screening compound: 4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]methyl}-2,6-dimethoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound D399-2433
4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]methyl}-2,6-dimethoxyphenol

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

D399-2433

Molecular Formula

C19H22FNO3 (C19 H22 FNO3)

Compound Name

4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]methyl}-2,6-dimethoxyphenol

IUPAC name

4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]methyl}-26-dimethoxyphenol

SMILES

COc1cc(CN(CCC2)C2c(cc2)ccc2F)cc(OC)c1O

InChI

InChI=1S/C19H22FNO3/c1-23-17-10-13(11-18(24-2)19(17)22)12-21-9-3-4-16(21)14-5-7-15(20)8-6-14/h5-8,10-11,16,22H,3-4,9,12H2,1-2H3/t16-/m0/s1

InChI Key

WSJQLWWWWYQZIU-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14826637

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.712

Distribution Coefficient, logD

0.226

Water Solubility, LogSw

-2.62

Polar Surface Area

34.665

Acid Dissociation Constant (pKa)

9.41

Base Dissociation Constant (pKb)

10.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

D399-2433 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D399-2433 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D399-2433?
Check Price and Availability of D399-2433, 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 D399-2433 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D399-2433
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D399-2433
  • 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 D399-2433 available by request