E157-2143 Screening compound: N-(5-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide

E157-2143 Screening compound: N-(5-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide
E157-2143 Screening compound: N-(5-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-2143
N-(5-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide

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

E157-2143

Molecular Formula

C20H20FN5O4S2 (C20 H20 FN5 O4 S2)

Compound Name

N-(5-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide

IUPAC name

N-(5-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}-134-thiadiazol-2-yl)-4-methoxybenzamide

SMILES

COc(cc1)ccc1C(Nc(s1)nnc1S(N(CC1)CCN1c(cc1)ccc1F)(=O)=O)=O

InChI

InChI=1S/C20H20FN5O4S2/c1-30-17-8-2-14(3-9-17)18(27)22-19-23-24-20(31-19)32(28,29)26-12-10-25(11-13-26)16-6-4-15(21)5-7-16/h2-9H,10-13H2,1H3,(H,22,23,27)

InChI Key

PJCWZRIPXKMXAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.548

Distribution Coefficient, logD

2.228

Water Solubility, LogSw

-3.80

Polar Surface Area

89.164

Acid Dissociation Constant (pKa)

6.10

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

E157-2143 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Purinergic Library (3321 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E157-2143 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-2143?
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What is the minimum amount of E157-2143 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-2143
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-2143
  • 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 E157-2143 available by request