D319-0696 Screening compound: N-(4-fluorophenyl)-4-methyl-1,2,3-thiadiazole-5-carboxamide

D319-0696 Screening compound: N-(4-fluorophenyl)-4-methyl-1,2,3-thiadiazole-5-carboxamide
D319-0696 Screening compound: N-(4-fluorophenyl)-4-methyl-1,2,3-thiadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D319-0696
N-(4-fluorophenyl)-4-methyl-1,2,3-thiadiazole-5-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

D319-0696

Molecular Formula

C10H8FN3OS (C10 H8 FN3 OS)

Compound Name

N-(4-fluorophenyl)-4-methyl-1,2,3-thiadiazole-5-carboxamide

IUPAC name

N-(4-fluorophenyl)-4-methyl-123-thiadiazole-5-carboxamide

SMILES

Cc1c(C(Nc(cc2)ccc2F)=O)snn1

InChI

InChI=1S/C10H8FN3OS/c1-6-9(16-14-13-6)10(15)12-8-4-2-7(11)3-5-8/h2-5H,1H3,(H,12,15)

InChI Key

WQAIZPRUUBPCFA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05741250

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

237.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.928

Distribution Coefficient, logD

1.890

Water Solubility, LogSw

-2.61

Polar Surface Area

45.773

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

-0.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

D319-0696 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Immune system
Structure:
  • Fragments
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D319-0696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D319-0696?
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What is the minimum amount of D319-0696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D319-0696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D319-0696
  • 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 D319-0696 available by request