D101-0360 Screening compound: 2-(4-bromo-2-methylphenoxy)-N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide

D101-0360 Screening compound: 2-(4-bromo-2-methylphenoxy)-N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide
D101-0360 Screening compound: 2-(4-bromo-2-methylphenoxy)-N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0360
2-(4-bromo-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

D101-0360

Molecular Formula

C19H18BrN3O3 (C19 H18 BrN3 O3)

Compound Name

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

IUPAC name

2-(4-bromo-2-methylphenoxy)-N-{[3-(3-methylphenyl)-124-oxadiazol-5-yl]methyl}acetamide

SMILES

Cc1cccc(-c2noc(CNC(COc(cc3)c(C)cc3Br)=O)n2)c1

InChI

InChI=1S/C19H18BrN3O3/c1-12-4-3-5-14(8-12)19-22-18(26-23-19)10-21-17(24)11-25-16-7-6-15(20)9-13(16)2/h3-9H,10-11H2,1-2H3,(H,21,24)

InChI Key

OHYDFTSLMAOPRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07629435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.27

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

5.104

Distribution Coefficient, logD

5.104

Water Solubility, LogSw

-4.99

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

References: we are preparing a list of scientific research reports with D101-0360 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0360?
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What is the minimum amount of D101-0360 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0360
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0360
  • 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 D101-0360 available by request