V004-7463 Screening compound: 3-(5-{[(2-fluorophenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)pyridine

V004-7463 Screening compound: 3-(5-{[(2-fluorophenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)pyridine
V004-7463 Screening compound: 3-(5-{[(2-fluorophenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-7463
3-(5-{[(2-fluorophenyl)methyl]sulfanyl}-4-(2-methylphenyl)-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

V004-7463

Molecular Formula

C21H17FN4S (C21 H17 FN4 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(cccc1)c1-n1c(SCc(cccc2)c2F)nnc1-c1cnccc1

InChI

InChI=1S/C21H17FN4S/c1-15-7-2-5-11-19(15)26-20(16-9-6-12-23-13-16)24-25-21(26)27-14-17-8-3-4-10-18(17)22/h2-13H,14H2,1H3

InChI Key

RWOITXMWHUCZKN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05298701

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

376.46

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

4.555

Distribution Coefficient, logD

4.551

Water Solubility, LogSw

-4.12

Polar Surface Area

33.929

Acid Dissociation Constant (pKa)

24.52

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

V004-7463 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with V004-7463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-7463?
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What is the minimum amount of V004-7463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-7463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-7463
  • 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 V004-7463 available by request