8294-0237 Screening compound: 6-(4-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile

8294-0237 Screening compound: 6-(4-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile
8294-0237 Screening compound: 6-(4-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8294-0237
6-(4-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile

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

8294-0237

Molecular Formula

C19H15N3OS (C19 H15 N3 OS)

Compound Name

6-(4-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile

IUPAC name

6-(4-methoxyphenyl)-2-{[(pyridin-2-yl)methyl]sulfanyl}pyridine-3-carbonitrile

SMILES

COc(cc1)ccc1-c(nc1SCc2ncccc2)ccc1C#N

InChI

InChI=1S/C19H15N3OS/c1-23-17-8-5-14(6-9-17)18-10-7-15(12-20)19(22-18)24-13-16-4-2-3-11-21-16/h2-11H,13H2,1H3

InChI Key

VJQHWIJOHFKBGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03730236

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.221

Distribution Coefficient, logD

4.220

Water Solubility, LogSw

-4.43

Polar Surface Area

42.586

Acid Dissociation Constant (pKa)

26.96

Base Dissociation Constant (pKb)

4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

8294-0237 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8294-0237 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8294-0237?
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What is the minimum amount of 8294-0237 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8294-0237
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8294-0237
  • 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 8294-0237 available by request