4964-1564 Screening compound: 1-(2-fluorobenzoyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine

4964-1564 Screening compound: 1-(2-fluorobenzoyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine
4964-1564 Screening compound: 1-(2-fluorobenzoyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4964-1564
1-(2-fluorobenzoyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine

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

4964-1564

Molecular Formula

C21H25FN2O4 (C21 H25 FN2 O4)

Compound Name

1-(2-fluorobenzoyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine

IUPAC name

1-(2-fluorobenzoyl)-4-[(234-trimethoxyphenyl)methyl]piperazine

SMILES

COc(ccc(CN(CC1)CCN1C(c(cccc1)c1F)=O)c1OC)c1OC

InChI

InChI=1S/C21H25FN2O4/c1-26-18-9-8-15(19(27-2)20(18)28-3)14-23-10-12-24(13-11-23)21(25)16-6-4-5-7-17(16)22/h4-9H,10-14H2,1-3H3

InChI Key

YFAREUPXSHTBLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02731236

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

388.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.502

Distribution Coefficient, logD

2.301

Water Solubility, LogSw

-2.74

Polar Surface Area

43.492

Acid Dissociation Constant (pKa)

28.30

Base Dissociation Constant (pKb)

7.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

4964-1564 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 4964-1564 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4964-1564?
Check Price and Availability of 4964-1564, 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 4964-1564 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4964-1564
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4964-1564
  • 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 4964-1564 available by request