D679-0191 Screening compound: 2,4-dimethoxy-N-{[5-(2-phenylethyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

D679-0191 Screening compound: 2,4-dimethoxy-N-{[5-(2-phenylethyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide
D679-0191 Screening compound: 2,4-dimethoxy-N-{[5-(2-phenylethyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D679-0191
2,4-dimethoxy-N-{[5-(2-phenylethyl)-1,2,4-oxadiazol-3-yl]methyl}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

D679-0191

Molecular Formula

C20H21N3O4 (C20 H21 N3 O4)

Compound Name

2,4-dimethoxy-N-{[5-(2-phenylethyl)-1,2,4-oxadiazol-3-yl]methyl}benzamide

IUPAC name

24-dimethoxy-N-{[5-(2-phenylethyl)-124-oxadiazol-3-yl]methyl}benzamide

SMILES

COc(cc1)cc(OC)c1C(NCc1noc(CCc2ccccc2)n1)=O

InChI

InChI=1S/C20H21N3O4/c1-25-15-9-10-16(17(12-15)26-2)20(24)21-13-18-22-19(27-23-18)11-8-14-6-4-3-5-7-14/h3-7,9-10,12H,8,11,13H2,1-2H3,(H,21,24)

InChI Key

OGQGCDWMGPGXPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.867

Distribution Coefficient, logD

3.867

Water Solubility, LogSw

-4.13

Polar Surface Area

72.159

Acid Dissociation Constant (pKa)

12.20

Base Dissociation Constant (pKb)

-3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with D679-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D679-0191?
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What is the minimum amount of D679-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D679-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D679-0191
  • 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 D679-0191 available by request