D321-0827 Screening compound: 4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4,6-trimethylphenyl)butanamide

D321-0827 Screening compound: 4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4,6-trimethylphenyl)butanamide
D321-0827 Screening compound: 4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4,6-trimethylphenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D321-0827
4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4,6-trimethylphenyl)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

D321-0827

Molecular Formula

C22H25N3O3 (C22 H25 N3 O3)

Compound Name

4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2,4,6-trimethylphenyl)butanamide

IUPAC name

4-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]-N-(246-trimethylphenyl)butanamide

SMILES

Cc(cc1C)cc(C)c1NC(CCCc1nc(-c(cc2)ccc2OC)no1)=O

InChI

InChI=1S/C22H25N3O3/c1-14-12-15(2)21(16(3)13-14)23-19(26)6-5-7-20-24-22(25-28-20)17-8-10-18(27-4)11-9-17/h8-13H,5-7H2,1-4H3,(H,23,26)

InChI Key

LFYKACLSFRXJCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09764582

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.46

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

4.316

Distribution Coefficient, logD

4.316

Water Solubility, LogSw

-4.35

Polar Surface Area

60.607

Acid Dissociation Constant (pKa)

11.92

Base Dissociation Constant (pKb)

1.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

D321-0827 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D321-0827 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D321-0827?
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What is the minimum amount of D321-0827 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D321-0827
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D321-0827
  • 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 D321-0827 available by request