F420-0588 Screening compound: ethyl 4-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]thiophene-2-amido}benzoate

F420-0588 Screening compound: ethyl 4-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]thiophene-2-amido}benzoate
F420-0588 Screening compound: ethyl 4-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]thiophene-2-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F420-0588
ethyl 4-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]thiophene-2-amido}benzoate

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

F420-0588

Molecular Formula

C23H24N2O6S2 (C23 H24 N2 O6 S2)

Compound Name

ethyl 4-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]thiophene-2-amido}benzoate

IUPAC name

ethyl 4-{3-[(4-ethoxyphenyl)(methyl)sulfamoyl]thiophene-2-amido}benzoate

SMILES

CCOC(c(cc1)ccc1NC(c(scc1)c1S(N(C)c(cc1)ccc1OCC)(=O)=O)=O)=O

InChI

InChI=1S/C23H24N2O6S2/c1-4-30-19-12-10-18(11-13-19)25(3)33(28,29)20-14-15-32-21(20)22(26)24-17-8-6-16(7-9-17)23(27)31-5-2/h6-15H,4-5H2,1-3H3,(H,24,26)

InChI Key

XKLOVKDDSINYIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27126506

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.59

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.950

Distribution Coefficient, logD

4.943

Water Solubility, LogSw

-4.39

Polar Surface Area

85.046

Acid Dissociation Constant (pKa)

9.16

Base Dissociation Constant (pKb)

-3.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

F420-0588 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with F420-0588 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F420-0588?
Check Price and Availability of F420-0588, 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 F420-0588 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F420-0588
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F420-0588
  • 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 F420-0588 available by request