D101-0473 Screening compound: N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(2,3,5-trimethylphenoxy)acetamide

D101-0473 Screening compound: N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(2,3,5-trimethylphenoxy)acetamide
D101-0473 Screening compound: N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(2,3,5-trimethylphenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D101-0473
N-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(2,3,5-trimethylphenoxy)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

D101-0473

Molecular Formula

C21H23N3O3 (C21 H23 N3 O3)

Compound Name

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

IUPAC name

N-{[3-(3-methylphenyl)-124-oxadiazol-5-yl]methyl}-2-(235-trimethylphenoxy)acetamide

SMILES

Cc1cccc(-c2noc(CNC(COc3c(C)c(C)cc(C)c3)=O)n2)c1

InChI

InChI=1S/C21H23N3O3/c1-13-6-5-7-17(9-13)21-23-20(27-24-21)11-22-19(25)12-26-18-10-14(2)8-15(3)16(18)4/h5-10H,11-12H2,1-4H3,(H,22,25)

InChI Key

AUNPQEVFTAZCOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07629122

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.43

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

5.107

Distribution Coefficient, logD

5.107

Water Solubility, LogSw

-4.93

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

28.60

References: we are preparing a list of scientific research reports with D101-0473 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D101-0473?
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What is the minimum amount of D101-0473 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D101-0473
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D101-0473
  • 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 D101-0473 available by request