8019-8316 Screening compound: 6-[(E)-2-(4-fluorophenyl)-1-ethenyl]-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

8019-8316 Screening compound: 6-[(E)-2-(4-fluorophenyl)-1-ethenyl]-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
8019-8316 Screening compound: 6-[(E)-2-(4-fluorophenyl)-1-ethenyl]-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8316
6-[(E)-2-(4-fluorophenyl)-1-ethenyl]-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

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

8019-8316

Molecular Formula

C14H13FN4S (C14 H13 FN4 S)

Compound Name

6-[(E)-2-(4-fluorophenyl)-1-ethenyl]-3-isopropyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

IUPAC name

n/a

SMILES

CC(C)c1nnc2sc(/C=C/c(cc3)ccc3F)nn12

InChI

InChI=1S/C14H13FN4S/c1-9(2)13-16-17-14-19(13)18-12(20-14)8-5-10-3-6-11(15)7-4-10/h3-9H,1-2H3

InChI Key

ZANVUFUXAHOAID-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.189

Distribution Coefficient, logD

3.189

Water Solubility, LogSw

-3.20

Polar Surface Area

34.488

Acid Dissociation Constant (pKa)

22.28

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with 8019-8316 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8316?
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What is the minimum amount of 8019-8316 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8316
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8316
  • 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 8019-8316 available by request