E157-6226 Screening compound: N-{5-[(4-methylphenyl)(2-methylpropyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}furan-2-carboxamide

E157-6226 Screening compound: N-{5-[(4-methylphenyl)(2-methylpropyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}furan-2-carboxamide
E157-6226 Screening compound: N-{5-[(4-methylphenyl)(2-methylpropyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-6226
N-{5-[(4-methylphenyl)(2-methylpropyl)sulfamoyl]-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

E157-6226

Molecular Formula

C18H20N4O4S2 (C18 H20 N4 O4 S2)

Compound Name

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

IUPAC name

N-{5-[(4-methylphenyl)(2-methylpropyl)sulfamoyl]-134-thiadiazol-2-yl}furan-2-carboxamide

SMILES

CC(C)CN(c1ccc(C)cc1)S(c1nnc(NC(c2ccco2)=O)s1)(=O)=O

InChI

InChI=1S/C18H20N4O4S2/c1-12(2)11-22(14-8-6-13(3)7-9-14)28(24,25)18-21-20-17(27-18)19-16(23)15-5-4-10-26-15/h4-10,12H,11H2,1-3H3,(H,19,20,23)

InChI Key

DDNDXIAXUMYGQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14844222

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.352

Distribution Coefficient, logD

3.388

Water Solubility, LogSw

-4.17

Polar Surface Area

87.053

Acid Dissociation Constant (pKa)

6.49

Base Dissociation Constant (pKb)

-7.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

E157-6226 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Anti-HIV1 Library (19540 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:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E157-6226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-6226?
Check Price and Availability of E157-6226, 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 E157-6226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-6226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-6226
  • 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 E157-6226 available by request