E880-0398 Screening compound: 2-fluoro-N-(5-{[(4-fluorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)benzamide

E880-0398 Screening compound: 2-fluoro-N-(5-{[(4-fluorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)benzamide
E880-0398 Screening compound: 2-fluoro-N-(5-{[(4-fluorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E880-0398
2-fluoro-N-(5-{[(4-fluorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)benzamide

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

E880-0398

Molecular Formula

C17H14F2N4O3S2 (C17 H14 F2 N4 O3 S2)

Compound Name

2-fluoro-N-(5-{[(4-fluorophenyl)methyl](methyl)sulfamoyl}-1,3,4-thiadiazol-2-yl)benzamide

IUPAC name

2-fluoro-N-(5-{[(4-fluorophenyl)methyl](methyl)sulfamoyl}-134-thiadiazol-2-yl)benzamide

SMILES

CN(Cc(cc1)ccc1F)S(c1nnc(NC(c(cccc2)c2F)=O)s1)(=O)=O

InChI

InChI=1S/C17H14F2N4O3S2/c1-23(10-11-6-8-12(18)9-7-11)28(25,26)17-22-21-16(27-17)20-15(24)13-4-2-3-5-14(13)19/h2-9H,10H2,1H3,(H,20,21,24)

InChI Key

NZNXXANJBLBZGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14925392

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.45

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

3.460

Distribution Coefficient, logD

0.917

Water Solubility, LogSw

-3.90

Polar Surface Area

79.214

Acid Dissociation Constant (pKa)

4.86

Base Dissociation Constant (pKb)

-7.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with E880-0398 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E880-0398?
Check Price and Availability of E880-0398, 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 E880-0398 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E880-0398
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E880-0398
  • 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 E880-0398 available by request