D679-0983 Screening compound: N-[(5-benzyl-1,2,4-oxadiazol-3-yl)methyl]-4-cyanobenzamide

D679-0983 Screening compound: N-[(5-benzyl-1,2,4-oxadiazol-3-yl)methyl]-4-cyanobenzamide
D679-0983 Screening compound: N-[(5-benzyl-1,2,4-oxadiazol-3-yl)methyl]-4-cyanobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D679-0983
N-[(5-benzyl-1,2,4-oxadiazol-3-yl)methyl]-4-cyanobenzamide

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

D679-0983

Molecular Formula

C18H14N4O2 (C18 H14 N4 O2)

Compound Name

N-[(5-benzyl-1,2,4-oxadiazol-3-yl)methyl]-4-cyanobenzamide

IUPAC name

N-[(5-benzyl-124-oxadiazol-3-yl)methyl]-4-cyanobenzamide

SMILES

N#Cc(cc1)ccc1C(NCc1noc(Cc2ccccc2)n1)=O

InChI

InChI=1S/C18H14N4O2/c19-11-14-6-8-15(9-7-14)18(23)20-12-16-21-17(24-22-16)10-13-4-2-1-3-5-13/h1-9H,10,12H2,(H,20,23)

InChI Key

RHNBBWRJARFZSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596328

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.33

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

2.639

Distribution Coefficient, logD

2.639

Water Solubility, LogSw

-2.96

Polar Surface Area

74.042

Acid Dissociation Constant (pKa)

12.57

Base Dissociation Constant (pKb)

-4.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with D679-0983 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D679-0983?
Check Price and Availability of D679-0983, 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 D679-0983 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D679-0983
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D679-0983
  • 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 D679-0983 available by request