D160-0001 Screening compound: N-(4-ethyl-1,2,5-oxadiazol-3-yl)benzamide

D160-0001 Screening compound: N-(4-ethyl-1,2,5-oxadiazol-3-yl)benzamide
D160-0001 Screening compound: N-(4-ethyl-1,2,5-oxadiazol-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D160-0001
N-(4-ethyl-1,2,5-oxadiazol-3-yl)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

D160-0001

Molecular Formula

C11H11N3O2 (C11 H11 N3 O2)

Compound Name

N-(4-ethyl-1,2,5-oxadiazol-3-yl)benzamide

IUPAC name

N-(4-ethyl-125-oxadiazol-3-yl)benzamide

SMILES

CCc1nonc1NC(c1ccccc1)=O

InChI

InChI=1S/C11H11N3O2/c1-2-9-10(14-16-13-9)12-11(15)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,12,14,15)

InChI Key

MRUITIPSKZIBQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06648476

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

217.23

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.264

Distribution Coefficient, logD

2.157

Water Solubility, LogSw

-2.78

Polar Surface Area

60.853

Acid Dissociation Constant (pKa)

7.96

Base Dissociation Constant (pKb)

-5.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

D160-0001 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with D160-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D160-0001?
Check Price and Availability of D160-0001, 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 D160-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D160-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D160-0001
  • 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 D160-0001 available by request