D678-0916 Screening compound: 3,4-diethoxy-N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

D678-0916 Screening compound: 3,4-diethoxy-N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide
D678-0916 Screening compound: 3,4-diethoxy-N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D678-0916
3,4-diethoxy-N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

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

D678-0916

Molecular Formula

C21H23N3O5 (C21 H23 N3 O5)

Compound Name

3,4-diethoxy-N-{[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

IUPAC name

34-diethoxy-N-{[5-(4-methoxyphenyl)-124-oxadiazol-3-yl]methyl}benzamide

SMILES

CCOc(ccc(C(NCc1noc(-c(cc2)ccc2OC)n1)=O)c1)c1OCC

InChI

InChI=1S/C21H23N3O5/c1-4-27-17-11-8-15(12-18(17)28-5-2)20(25)22-13-19-23-21(29-24-19)14-6-9-16(26-3)10-7-14/h6-12H,4-5,13H2,1-3H3,(H,22,25)

InChI Key

ZXBFLLGXTZMDNE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.070

Distribution Coefficient, logD

3.070

Water Solubility, LogSw

-3.33

Polar Surface Area

79.284

Acid Dissociation Constant (pKa)

13.48

Base Dissociation Constant (pKb)

-5.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

D678-0916 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with D678-0916 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D678-0916?
Check Price and Availability of D678-0916, 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 D678-0916 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D678-0916
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D678-0916
  • 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 D678-0916 available by request