D134-0552 Screening compound: N-[(furan-2-yl)methyl]-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamide

D134-0552 Screening compound: N-[(furan-2-yl)methyl]-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamide
D134-0552 Screening compound: N-[(furan-2-yl)methyl]-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D134-0552
N-[(furan-2-yl)methyl]-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamide

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

D134-0552

Molecular Formula

C20H23N3O6 (C20 H23 N3 O6)

Compound Name

N-[(furan-2-yl)methyl]-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]butanamide

IUPAC name

N-[(furan-2-yl)methyl]-4-[3-(345-trimethoxyphenyl)-124-oxadiazol-5-yl]butanamide

SMILES

COc1cc(-c2noc(CCCC(NCc3ccco3)=O)n2)cc(OC)c1OC

InChI

InChI=1S/C20H23N3O6/c1-25-15-10-13(11-16(26-2)19(15)27-3)20-22-18(29-23-20)8-4-7-17(24)21-12-14-6-5-9-28-14/h5-6,9-11H,4,7-8,12H2,1-3H3,(H,21,24)

InChI Key

APPYSOQEHIXVQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06613903

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.754

Distribution Coefficient, logD

2.754

Water Solubility, LogSw

-3.25

Polar Surface Area

86.508

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

D134-0552 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D134-0552 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D134-0552?
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What is the minimum amount of D134-0552 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D134-0552
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D134-0552
  • 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 D134-0552 available by request