D679-0031 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-4-ethoxybenzamide

D679-0031 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-4-ethoxybenzamide
D679-0031 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-4-ethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D679-0031
N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-4-ethoxybenzamide

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

D679-0031

Molecular Formula

C17H21N3O3 (C17 H21 N3 O3)

Compound Name

N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-4-ethoxybenzamide

IUPAC name

N-[(5-cyclopentyl-124-oxadiazol-3-yl)methyl]-4-ethoxybenzamide

SMILES

CCOc(cc1)ccc1C(NCc1noc(C2CCCC2)n1)=O

InChI

InChI=1S/C17H21N3O3/c1-2-22-14-9-7-12(8-10-14)16(21)18-11-15-19-17(23-20-15)13-5-3-4-6-13/h7-10,13H,2-6,11H2,1H3,(H,18,21)

InChI Key

YBBRZQUFMOSGHB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596081

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.488

Distribution Coefficient, logD

3.488

Water Solubility, LogSw

-3.49

Polar Surface Area

65.001

Acid Dissociation Constant (pKa)

13.48

Base Dissociation Constant (pKb)

-2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.10

D679-0031 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D679-0031 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D679-0031?
Check Price and Availability of D679-0031, 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 D679-0031 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D679-0031
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D679-0031
  • 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 D679-0031 available by request