D654-0218 Screening compound: 2-(2-methoxyphenoxy)-N-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide

D654-0218 Screening compound: 2-(2-methoxyphenoxy)-N-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide
D654-0218 Screening compound: 2-(2-methoxyphenoxy)-N-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D654-0218
2-(2-methoxyphenoxy)-N-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide

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

D654-0218

Molecular Formula

C25H23N3O5 (C25 H23 N3 O5)

Compound Name

2-(2-methoxyphenoxy)-N-{2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl}propanamide

IUPAC name

2-(2-methoxyphenoxy)-N-{2-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]phenyl}propanamide

SMILES

CC(C(Nc(cccc1)c1-c1nc(-c(cc2)ccc2OC)no1)=O)Oc(cccc1)c1OC

InChI

InChI=1S/C25H23N3O5/c1-16(32-22-11-7-6-10-21(22)31-3)24(29)26-20-9-5-4-8-19(20)25-27-23(28-33-25)17-12-14-18(30-2)15-13-17/h4-16H,1-3H3,(H,26,29)/t16-/m0/s1

InChI Key

DKPJNBPFJVTTGE-INIZCTEOSA-N

MDL Number (MFCD)

MFCD18078929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.123

Distribution Coefficient, logD

5.123

Water Solubility, LogSw

-4.91

Polar Surface Area

76.087

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

-1.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

D654-0218 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with D654-0218 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D654-0218?
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What is the minimum amount of D654-0218 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D654-0218
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D654-0218
  • 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 D654-0218 available by request