7641-0599 Screening compound: 2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxyphenyl)-1,3,4-oxadiazole

7641-0599 Screening compound: 2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxyphenyl)-1,3,4-oxadiazole
7641-0599 Screening compound: 2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxyphenyl)-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 7641-0599
2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxyphenyl)-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

7641-0599

Molecular Formula

C17H15ClN2O2S (C17 H15 ClN2 O2 S)

Compound Name

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

IUPAC name

2-{[(4-chlorophenyl)methyl]sulfanyl}-5-(2-ethoxyphenyl)-134-oxadiazole

SMILES

CCOc(cccc1)c1-c(o1)nnc1SCc(cc1)ccc1Cl

InChI

InChI=1S/C17H15ClN2O2S/c1-2-21-15-6-4-3-5-14(15)16-19-20-17(22-16)23-11-12-7-9-13(18)10-8-12/h3-10H,2,11H2,1H3

InChI Key

DKGBATRJSLQGRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05841420

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.84

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

4.089

Distribution Coefficient, logD

4.089

Water Solubility, LogSw

-4.50

Polar Surface Area

37.274

Acid Dissociation Constant (pKa)

24.21

Base Dissociation Constant (pKb)

-1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

7641-0599 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-infective Library (19449 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 7641-0599 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7641-0599?
Check Price and Availability of 7641-0599, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 7641-0599 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7641-0599
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7641-0599
  • 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 7641-0599 available by request