4340-1696 Screening compound: (2Z)-2-(benzenesulfonyl)-3-[5-(4-bromophenyl)furan-2-yl]-N-[(pyridin-3-yl)methyl]prop-2-enamide

4340-1696 Screening compound: (2Z)-2-(benzenesulfonyl)-3-[5-(4-bromophenyl)furan-2-yl]-N-[(pyridin-3-yl)methyl]prop-2-enamide
4340-1696 Screening compound: (2Z)-2-(benzenesulfonyl)-3-[5-(4-bromophenyl)furan-2-yl]-N-[(pyridin-3-yl)methyl]prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4340-1696
(2Z)-2-(benzenesulfonyl)-3-[5-(4-bromophenyl)furan-2-yl]-N-[(pyridin-3-yl)methyl]prop-2-enamide

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

4340-1696

Molecular Formula

C25H19BrN2O4S (C25 H19 BrN2 O4 S)

Compound Name

(2Z)-2-(benzenesulfonyl)-3-[5-(4-bromophenyl)furan-2-yl]-N-[(pyridin-3-yl)methyl]prop-2-enamide

IUPAC name

(2Z)-2-(benzenesulfonyl)-3-[5-(4-bromophenyl)furan-2-yl]-N-[(pyridin-3-yl)methyl]prop-2-enamide

SMILES

O=C(/C(/S(c1ccccc1)(=O)=O)=C/c1ccc(-c(cc2)ccc2Br)o1)NCc1cnccc1

InChI

InChI=1S/C25H19BrN2O4S/c26-20-10-8-19(9-11-20)23-13-12-21(32-23)15-24(33(30,31)22-6-2-1-3-7-22)25(29)28-17-18-5-4-14-27-16-18/h1-16H,17H2,(H,28,29)

InChI Key

BTMSTXDOHAMGPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03016733

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

523.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.858

Distribution Coefficient, logD

4.857

Water Solubility, LogSw

-4.69

Polar Surface Area

71.240

Acid Dissociation Constant (pKa)

12.75

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

4340-1696 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 4340-1696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4340-1696?
Check Price and Availability of 4340-1696, 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 4340-1696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4340-1696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4340-1696
  • 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 4340-1696 available by request