E157-7807 Screening compound: N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-4-fluorobenzamide

E157-7807 Screening compound: N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-4-fluorobenzamide
E157-7807 Screening compound: N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-7807
N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-4-fluorobenzamide

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

E157-7807

Molecular Formula

C17H15FN4O3S2 (C17 H15 FN4 O3 S2)

Compound Name

N-{5-[benzyl(methyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-4-fluorobenzamide

IUPAC name

N-{5-[benzyl(methyl)sulfamoyl]-134-thiadiazol-2-yl}-4-fluorobenzamide

SMILES

CN(Cc1ccccc1)S(c1nnc(NC(c(cc2)ccc2F)=O)s1)(=O)=O

InChI

InChI=1S/C17H15FN4O3S2/c1-22(11-12-5-3-2-4-6-12)27(24,25)17-21-20-16(26-17)19-15(23)13-7-9-14(18)10-8-13/h2-10H,11H2,1H3,(H,19,20,23)

InChI Key

UNEKHEDOSLYRKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14844352

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.477

Distribution Coefficient, logD

0.934

Water Solubility, LogSw

-3.84

Polar Surface Area

79.214

Acid Dissociation Constant (pKa)

4.86

Base Dissociation Constant (pKb)

-6.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

E157-7807 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 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

References: we are preparing a list of scientific research reports with E157-7807 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-7807?
Check Price and Availability of E157-7807, 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 E157-7807 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-7807
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-7807
  • 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 E157-7807 available by request