V018-0913 Screening compound: 3-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine

V018-0913 Screening compound: 3-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine
V018-0913 Screening compound: 3-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-0913
3-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine

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

V018-0913

Molecular Formula

C20H14F2N4S (C20 H14 F2 N4 S)

Compound Name

3-(5-{[(3,5-difluorophenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine

IUPAC name

3-(5-{[(35-difluorophenyl)methyl]sulfanyl}-4-phenyl-4H-124-triazol-3-yl)pyridine

SMILES

Fc1cc(CSc2nnc(-c3cnccc3)n2-c2ccccc2)cc(F)c1

InChI

InChI=1S/C20H14F2N4S/c21-16-9-14(10-17(22)11-16)13-27-20-25-24-19(15-5-4-8-23-12-15)26(20)18-6-2-1-3-7-18/h1-12H,13H2

InChI Key

VXXURNVKRBGRFE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19844211

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

380.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.195

Distribution Coefficient, logD

4.191

Water Solubility, LogSw

-4.26

Polar Surface Area

34.230

Acid Dissociation Constant (pKa)

23.74

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with V018-0913 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-0913?
Check Price and Availability of V018-0913, 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 V018-0913 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-0913
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-0913
  • 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 V018-0913 available by request