D134-0600 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(furan-2-yl)methyl]butanamide

D134-0600 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(furan-2-yl)methyl]butanamide
D134-0600 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(furan-2-yl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D134-0600
4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[(furan-2-yl)methyl]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

D134-0600

Molecular Formula

C17H16ClN3O3 (C17 H16 ClN3 O3)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCCc1nc(-c(cc2)ccc2Cl)no1)NCc1ccco1

InChI

InChI=1S/C17H16ClN3O3/c18-13-8-6-12(7-9-13)17-20-16(24-21-17)5-1-4-15(22)19-11-14-3-2-10-23-14/h2-3,6-10H,1,4-5,11H2,(H,19,22)

InChI Key

PWKQCKZTVLIBCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07188010

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.79

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

3.866

Distribution Coefficient, logD

3.866

Water Solubility, LogSw

-4.53

Polar Surface Area

63.530

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

-2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D134-0600 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with D134-0600 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D134-0600?
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What is the minimum amount of D134-0600 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D134-0600
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D134-0600
  • 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 D134-0600 available by request