D080-0054 Screening compound: 2-(chloromethyl)-5-(2-chlorophenyl)-1,3,4-oxadiazole

D080-0054 Screening compound: 2-(chloromethyl)-5-(2-chlorophenyl)-1,3,4-oxadiazole
D080-0054 Screening compound: 2-(chloromethyl)-5-(2-chlorophenyl)-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D080-0054
2-(chloromethyl)-5-(2-chlorophenyl)-1,3,4-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

D080-0054

Molecular Formula

C9H6Cl2N2O (C9 H6 Cl2 N2 O)

Compound Name

2-(chloromethyl)-5-(2-chlorophenyl)-1,3,4-oxadiazole

IUPAC name

2-(chloromethyl)-5-(2-chlorophenyl)-134-oxadiazole

SMILES

ClCc1nnc(-c(cccc2)c2Cl)o1

InChI

InChI=1S/C9H6Cl2N2O/c10-5-8-12-13-9(14-8)6-3-1-2-4-7(6)11/h1-4H,5H2

InChI Key

VOQHBNXZBQTWKZ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

229.06

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.436

Distribution Coefficient, logD

2.436

Water Solubility, LogSw

-3.32

Polar Surface Area

30.420

Acid Dissociation Constant (pKa)

27.77

Base Dissociation Constant (pKb)

-4.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with D080-0054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D080-0054?
Check Price and Availability of D080-0054, 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 D080-0054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D080-0054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D080-0054
  • 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 D080-0054 available by request