D679-1318 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-diethoxybenzamide

D679-1318 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-diethoxybenzamide
D679-1318 Screening compound: N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-diethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D679-1318
N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3,4-diethoxybenzamide

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

D679-1318

Molecular Formula

C19H25N3O4 (C19 H25 N3 O4)

Compound Name

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

IUPAC name

N-[(5-cyclopentyl-124-oxadiazol-3-yl)methyl]-34-diethoxybenzamide

SMILES

CCOc(ccc(C(NCc1noc(C2CCCC2)n1)=O)c1)c1OCC

InChI

InChI=1S/C19H25N3O4/c1-3-24-15-10-9-14(11-16(15)25-4-2)18(23)20-12-17-21-19(26-22-17)13-7-5-6-8-13/h9-11,13H,3-8,12H2,1-2H3,(H,20,23)

InChI Key

RYNJYNRRCGUHJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596387

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.234

Distribution Coefficient, logD

3.234

Water Solubility, LogSw

-3.32

Polar Surface Area

72.298

Acid Dissociation Constant (pKa)

14.09

Base Dissociation Constant (pKb)

-2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.60

D679-1318 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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 D679-1318 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D679-1318?
Check Price and Availability of D679-1318, 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 D679-1318 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D679-1318
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D679-1318
  • 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 D679-1318 available by request