8017-7793 Screening compound: 3-(2H-1,3-benzodioxol-5-yl)-5-(2-ethoxyphenyl)-1,2,4-oxadiazole

8017-7793 Screening compound: 3-(2H-1,3-benzodioxol-5-yl)-5-(2-ethoxyphenyl)-1,2,4-oxadiazole
8017-7793 Screening compound: 3-(2H-1,3-benzodioxol-5-yl)-5-(2-ethoxyphenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-7793
3-(2H-1,3-benzodioxol-5-yl)-5-(2-ethoxyphenyl)-1,2,4-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

8017-7793

Molecular Formula

C17H14N2O4 (C17 H14 N2 O4)

Compound Name

3-(2H-1,3-benzodioxol-5-yl)-5-(2-ethoxyphenyl)-1,2,4-oxadiazole

IUPAC name

3-(2H-13-benzodioxol-5-yl)-5-(2-ethoxyphenyl)-124-oxadiazole

SMILES

CCOc(cccc1)c1-c1nc(-c(cc2)cc3c2OCO3)no1

InChI

InChI=1S/C17H14N2O4/c1-2-20-13-6-4-3-5-12(13)17-18-16(19-23-17)11-7-8-14-15(9-11)22-10-21-14/h3-9H,2,10H2,1H3

InChI Key

DLNXROUHLXDVEN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06618136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.264

Distribution Coefficient, logD

4.264

Water Solubility, LogSw

-4.35

Polar Surface Area

55.970

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

-4.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

8017-7793 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8017-7793 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-7793?
Check Price and Availability of 8017-7793, 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 8017-7793 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-7793
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-7793
  • 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 8017-7793 available by request