4378-0246 Screening compound: 2-{[2-(ethanesulfinyl)ethyl]sulfanyl}-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile

4378-0246 Screening compound: 2-{[2-(ethanesulfinyl)ethyl]sulfanyl}-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile
4378-0246 Screening compound: 2-{[2-(ethanesulfinyl)ethyl]sulfanyl}-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 4378-0246
2-{[2-(ethanesulfinyl)ethyl]sulfanyl}-6-(4-methoxyphenyl)-4-phenylpyridine-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

4378-0246

Molecular Formula

C23H22N2O2S2 (C23 H22 N2 O2 S2)

Compound Name

2-{[2-(ethanesulfinyl)ethyl]sulfanyl}-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile

IUPAC name

2-{[2-(ethanesulfinyl)ethyl]sulfanyl}-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile

SMILES

CCS(CCSc1nc(-c(cc2)ccc2OC)cc(-c2ccccc2)c1C#N)=O

InChI

InChI=1S/C23H24N2O2S2/c1-3-29(26)14-13-28-23-21(16-24)20(17-7-5-4-6-8-17)15-22(25-23)18-9-11-19(27-2)12-10-18/h4-12,15H,3,13-14,29H2,1-2H3

InChI Key

AAAXCOVYJDMGQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02973037

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.966

Distribution Coefficient, logD

4.966

Water Solubility, LogSw

-4.81

Polar Surface Area

48.087

Acid Dissociation Constant (pKa)

26.78

Base Dissociation Constant (pKb)

0.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with 4378-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4378-0246?
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What is the minimum amount of 4378-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4378-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4378-0246
  • 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 4378-0246 available by request