4567-0304 Screening compound: 2-{N-[(4-bromophenyl)methyl]benzenesulfonamido}-N-[(pyridin-2-yl)methyl]acetamide

4567-0304 Screening compound: 2-{N-[(4-bromophenyl)methyl]benzenesulfonamido}-N-[(pyridin-2-yl)methyl]acetamide
4567-0304 Screening compound: 2-{N-[(4-bromophenyl)methyl]benzenesulfonamido}-N-[(pyridin-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4567-0304
2-{N-[(4-bromophenyl)methyl]benzenesulfonamido}-N-[(pyridin-2-yl)methyl]acetamide

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

4567-0304

Molecular Formula

C21H20BrN3O3S (C21 H20 BrN3 O3 S)

Compound Name

2-{N-[(4-bromophenyl)methyl]benzenesulfonamido}-N-[(pyridin-2-yl)methyl]acetamide

IUPAC name

2-{N-[(4-bromophenyl)methyl]benzenesulfonamido}-N-[(pyridin-2-yl)methyl]acetamide

SMILES

O=C(CN(Cc(cc1)ccc1Br)S(c1ccccc1)(=O)=O)NCc1ncccc1

InChI

InChI=1S/C21H20BrN3O3S/c22-18-11-9-17(10-12-18)15-25(29(27,28)20-7-2-1-3-8-20)16-21(26)24-14-19-6-4-5-13-23-19/h1-13H,14-16H2,(H,24,26)

InChI Key

QLUJXBLCPQJKGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03017611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.506

Distribution Coefficient, logD

3.505

Water Solubility, LogSw

-3.65

Polar Surface Area

65.357

Acid Dissociation Constant (pKa)

11.17

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

4567-0304 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

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

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
  • Nervous system
Mechanism of action:
  • PPI modulators
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 4567-0304 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4567-0304?
Check Price and Availability of 4567-0304, 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 4567-0304 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4567-0304
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4567-0304
  • 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 4567-0304 available by request