V028-6556 Screening compound: 4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethane-1-sulfonate

V028-6556 Screening compound: 4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethane-1-sulfonate
V028-6556 Screening compound: 4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethane-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-6556
4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethane-1-sulfonate

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

V028-6556

Molecular Formula

C23H25NO5S (C23 H25 NO5 S)

Compound Name

4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethane-1-sulfonate

IUPAC name

4-({N-[(furan-2-yl)methyl]-3-phenylpropanamido}methyl)phenyl ethane-1-sulfonate

SMILES

CCS(Oc1ccc(CN(Cc2ccco2)C(CCc2ccccc2)=O)cc1)(=O)=O

InChI

InChI=1S/C23H25NO5S/c1-2-30(26,27)29-21-13-10-20(11-14-21)17-24(18-22-9-6-16-28-22)23(25)15-12-19-7-4-3-5-8-19/h3-11,13-14,16H,2,12,15,17-18H2,1H3

InChI Key

LEDIDXORSBMDDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19741356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.807

Distribution Coefficient, logD

3.807

Water Solubility, LogSw

-3.84

Polar Surface Area

58.508

Acid Dissociation Constant (pKa)

21.62

Base Dissociation Constant (pKb)

-4.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

V028-6556 in Drug Discovery

Included in Screening Libraries

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V028-6556 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-6556?
Check Price and Availability of V028-6556, 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 V028-6556 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-6556
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-6556
  • 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 V028-6556 available by request