D321-0381 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-hydroxyphenyl)butanamide

D321-0381 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-hydroxyphenyl)butanamide
D321-0381 Screening compound: 4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-hydroxyphenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D321-0381
4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-hydroxyphenyl)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

D321-0381

Molecular Formula

C18H16ClN3O3 (C18 H16 ClN3 O3)

Compound Name

4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-hydroxyphenyl)butanamide

IUPAC name

4-[3-(4-chlorophenyl)-124-oxadiazol-5-yl]-N-(4-hydroxyphenyl)butanamide

SMILES

Oc(cc1)ccc1NC(CCCc1nc(-c(cc2)ccc2Cl)no1)=O

InChI

InChI=1S/C18H16ClN3O3/c19-13-6-4-12(5-7-13)18-21-17(25-22-18)3-1-2-16(24)20-14-8-10-15(23)11-9-14/h4-11,23H,1-3H2,(H,20,24)

InChI Key

JVFCZUUNUMUWCX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14819083

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.8

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.796

Distribution Coefficient, logD

3.795

Water Solubility, LogSw

-4.39

Polar Surface Area

72.076

Acid Dissociation Constant (pKa)

10.11

Base Dissociation Constant (pKb)

1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

D321-0381 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with D321-0381 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D321-0381?
Check Price and Availability of D321-0381, 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 D321-0381 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D321-0381
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D321-0381
  • 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 D321-0381 available by request