D705-0731 Screening compound: N-[(2-chlorophenyl)methyl]-2-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenoxy}acetamide

D705-0731 Screening compound: N-[(2-chlorophenyl)methyl]-2-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenoxy}acetamide
D705-0731 Screening compound: N-[(2-chlorophenyl)methyl]-2-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenoxy}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D705-0731
N-[(2-chlorophenyl)methyl]-2-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenoxy}acetamide

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

D705-0731

Molecular Formula

C20H20ClN3O3 (C20 H20 ClN3 O3)

Compound Name

N-[(2-chlorophenyl)methyl]-2-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]phenoxy}acetamide

IUPAC name

N-[(2-chlorophenyl)methyl]-2-{4-[3-(propan-2-yl)-124-oxadiazol-5-yl]phenoxy}acetamide

SMILES

CC(C)c1noc(-c(cc2)ccc2OCC(NCc(cccc2)c2Cl)=O)n1

InChI

InChI=1S/C20H20ClN3O3/c1-13(2)19-23-20(27-24-19)14-7-9-16(10-8-14)26-12-18(25)22-11-15-5-3-4-6-17(15)21/h3-10,13H,11-12H2,1-2H3,(H,22,25)

InChI Key

HDJXFLXYXCQMGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11705149

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.85

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.481

Distribution Coefficient, logD

4.481

Water Solubility, LogSw

-4.40

Polar Surface Area

63.615

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

-2.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with D705-0731 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D705-0731?
Check Price and Availability of D705-0731, 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 D705-0731 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D705-0731
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D705-0731
  • 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 D705-0731 available by request