E157-1983 Screening compound: N-(5-{[4-(4-methylphenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide

E157-1983 Screening compound: N-(5-{[4-(4-methylphenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
E157-1983 Screening compound: N-(5-{[4-(4-methylphenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-1983
N-(5-{[4-(4-methylphenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide

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

E157-1983

Molecular Formula

C18H19N5O4S2 (C18 H19 N5 O4 S2)

Compound Name

N-(5-{[4-(4-methylphenyl)piperazin-1-yl]sulfonyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide

IUPAC name

N-(5-{[4-(4-methylphenyl)piperazin-1-yl]sulfonyl}-134-thiadiazol-2-yl)furan-2-carboxamide

SMILES

Cc(cc1)ccc1N(CC1)CCN1S(c1nnc(NC(c2ccco2)=O)s1)(=O)=O

InChI

InChI=1S/C18H19N5O4S2/c1-13-4-6-14(7-5-13)22-8-10-23(11-9-22)29(25,26)18-21-20-17(28-18)19-16(24)15-3-2-12-27-15/h2-7,12H,8-11H2,1H3,(H,19,20,24)

InChI Key

OJIBOASFFLVRRH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843588

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.232

Distribution Coefficient, logD

2.049

Water Solubility, LogSw

-3.42

Polar Surface Area

90.199

Acid Dissociation Constant (pKa)

6.25

Base Dissociation Constant (pKb)

5.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

E157-1983 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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 E157-1983 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-1983?
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What is the minimum amount of E157-1983 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-1983
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-1983
  • 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 E157-1983 available by request