8436-0573 Screening compound: 2-(3-methoxyphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-oxadiazole

8436-0573 Screening compound: 2-(3-methoxyphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-oxadiazole
8436-0573 Screening compound: 2-(3-methoxyphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8436-0573
2-(3-methoxyphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-oxadiazole

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

8436-0573

Molecular Formula

C17H16N2O2S (C17 H16 N2 O2 S)

Compound Name

2-(3-methoxyphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-oxadiazole

IUPAC name

2-(3-methoxyphenyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-134-oxadiazole

SMILES

Cc1ccc(CSc2nnc(-c3cc(OC)ccc3)o2)cc1

InChI

InChI=1S/C17H16N2O2S/c1-12-6-8-13(9-7-12)11-22-17-19-18-16(21-17)14-4-3-5-15(10-14)20-2/h3-10H,11H2,1-2H3

InChI Key

DEBZHQRHBUYLCA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10465630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.810

Distribution Coefficient, logD

3.810

Water Solubility, LogSw

-3.94

Polar Surface Area

37.608

Acid Dissociation Constant (pKa)

24.68

Base Dissociation Constant (pKb)

-3.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

8436-0573 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8436-0573 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8436-0573?
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What is the minimum amount of 8436-0573 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8436-0573
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8436-0573
  • 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 8436-0573 available by request