V001-4806 Screening compound: 2-({[5-(4-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)pyridine

V001-4806 Screening compound: 2-({[5-(4-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)pyridine
V001-4806 Screening compound: 2-({[5-(4-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-4806
2-({[5-(4-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)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

V001-4806

Molecular Formula

C20H15FN4S (C20 H15 FN4 S)

Compound Name

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

IUPAC name

2-({[5-(4-fluorophenyl)-4-phenyl-4H-124-triazol-3-yl]sulfanyl}methyl)pyridine

SMILES

Fc(cc1)ccc1-c(n1-c2ccccc2)nnc1SCc1ncccc1

InChI

InChI=1S/C20H15FN4S/c21-16-11-9-15(10-12-16)19-23-24-20(25(19)18-7-2-1-3-8-18)26-14-17-6-4-5-13-22-17/h1-13H,14H2

InChI Key

RNUPOIVQOXSXAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19843798

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

362.43

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

4.224

Distribution Coefficient, logD

4.222

Water Solubility, LogSw

-4.48

Polar Surface Area

34.256

Acid Dissociation Constant (pKa)

25.77

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

V001-4806 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V001-4806 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-4806?
Check Price and Availability of V001-4806, 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 V001-4806 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-4806
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-4806
  • 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 V001-4806 available by request