E157-5698 Screening compound: N-{5-[ethyl(2-methylphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-4-fluorobenzamide

E157-5698 Screening compound: N-{5-[ethyl(2-methylphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-4-fluorobenzamide
E157-5698 Screening compound: N-{5-[ethyl(2-methylphenyl)sulfamoyl]-1,3,4-thiadiazol-2-yl}-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E157-5698
N-{5-[ethyl(2-methylphenyl)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

E157-5698

Molecular Formula

C18H17FN4O3S2 (C18 H17 FN4 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

CCN(c1c(C)cccc1)S(c1nnc(NC(c(cc2)ccc2F)=O)s1)(=O)=O

InChI

InChI=1S/C18H17FN4O3S2/c1-3-23(15-7-5-4-6-12(15)2)28(25,26)18-22-21-17(27-18)20-16(24)13-8-10-14(19)11-9-13/h4-11H,3H2,1-2H3,(H,20,21,24)

InChI Key

SACGHUPNMFFNQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14844143

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.106

Distribution Coefficient, logD

1.800

Water Solubility, LogSw

-4.10

Polar Surface Area

77.899

Acid Dissociation Constant (pKa)

5.10

Base Dissociation Constant (pKb)

-8.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with E157-5698 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E157-5698?
Check Price and Availability of E157-5698, 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 E157-5698 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E157-5698
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E157-5698
  • 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 E157-5698 available by request