D101-0263 Screening compound: 2-(2-methylphenoxy)-N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide

D101-0263 Screening compound: 2-(2-methylphenoxy)-N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide
D101-0263 Screening compound: 2-(2-methylphenoxy)-N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0263
2-(2-methylphenoxy)-N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}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

D101-0263

Molecular Formula

C19H19N3O3 (C19 H19 N3 O3)

Compound Name

2-(2-methylphenoxy)-N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide

IUPAC name

2-(2-methylphenoxy)-N-{[3-(3-methylphenyl)-124-oxadiazol-5-yl]methyl}acetamide

SMILES

Cc1cccc(-c2noc(CNC(COc3c(C)cccc3)=O)n2)c1

InChI

InChI=1S/C19H19N3O3/c1-13-6-5-8-15(10-13)19-21-18(25-22-19)11-20-17(23)12-24-16-9-4-3-7-14(16)2/h3-10H,11-12H2,1-2H3,(H,20,23)

InChI Key

XBSAVGCHXNJQHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07363406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.119

Distribution Coefficient, logD

4.119

Water Solubility, LogSw

-4.37

Polar Surface Area

63.367

Acid Dissociation Constant (pKa)

13.24

Base Dissociation Constant (pKb)

-4.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D101-0263 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with D101-0263 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0263?
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What is the minimum amount of D101-0263 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0263
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0263
  • 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 D101-0263 available by request