V015-3013 Screening compound: 3-[4-(4-methylphenyl)-5-{[(pyridin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine

V015-3013 Screening compound: 3-[4-(4-methylphenyl)-5-{[(pyridin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine
V015-3013 Screening compound: 3-[4-(4-methylphenyl)-5-{[(pyridin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-3013
3-[4-(4-methylphenyl)-5-{[(pyridin-2-yl)methyl]sulfanyl}-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

V015-3013

Molecular Formula

C20H17N5S (C20 H17 N5 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1-n1c(SCc2ncccc2)nnc1-c1cnccc1

InChI

InChI=1S/C20H17N5S/c1-15-7-9-18(10-8-15)25-19(16-5-4-11-21-13-16)23-24-20(25)26-14-17-6-2-3-12-22-17/h2-13H,14H2,1H3

InChI Key

RJKQKRKUBZCTOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19844238

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

359.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.259

Distribution Coefficient, logD

3.255

Water Solubility, LogSw

-2.97

Polar Surface Area

43.773

Acid Dissociation Constant (pKa)

25.77

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with V015-3013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-3013?
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What is the minimum amount of V015-3013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-3013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-3013
  • 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 V015-3013 available by request