E554-0116 Screening compound: N-(3-chlorophenyl)-N-ethyl-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamide

E554-0116 Screening compound: N-(3-chlorophenyl)-N-ethyl-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamide
E554-0116 Screening compound: N-(3-chlorophenyl)-N-ethyl-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E554-0116
N-(3-chlorophenyl)-N-ethyl-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]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

E554-0116

Molecular Formula

C19H18ClN3O3 (C19 H18 ClN3 O3)

Compound Name

N-(3-chlorophenyl)-N-ethyl-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamide

IUPAC name

N-(3-chlorophenyl)-N-ethyl-2-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]acetamide

SMILES

CCN(C(Cc1nc(-c(cc2)ccc2OC)no1)=O)c1cccc(Cl)c1

InChI

InChI=1S/C19H18ClN3O3/c1-3-23(15-6-4-5-14(20)11-15)18(24)12-17-21-19(22-26-17)13-7-9-16(25-2)10-8-13/h4-11H,3,12H2,1-2H3

InChI Key

NUDINGLVZRIQBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14898306

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.82

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.836

Distribution Coefficient, logD

4.836

Water Solubility, LogSw

-4.89

Polar Surface Area

53.945

Acid Dissociation Constant (pKa)

18.27

Base Dissociation Constant (pKb)

-0.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

E554-0116 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 E554-0116 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E554-0116?
Check Price and Availability of E554-0116, 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 E554-0116 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E554-0116
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E554-0116
  • 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 E554-0116 available by request