D349-0385 Screening compound: 2-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenoxy}-N~1~-(2-pyrimidinyl)acetamide

D349-0385 Screening compound: 2-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenoxy}-N~1~-(2-pyrimidinyl)acetamide
D349-0385 Screening compound: 2-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenoxy}-N~1~-(2-pyrimidinyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D349-0385
2-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenoxy}-N~1~-(2-pyrimidinyl)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

D349-0385

Molecular Formula

C21H17N5O3 (C21 H17 N5 O3)

Compound Name

2-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenoxy}-N~1~-(2-pyrimidinyl)acetamide

IUPAC name

n/a

SMILES

Cc1cccc(-c2noc(-c(cccc3)c3OCC(Nc3ncccn3)=O)n2)c1

InChI

InChI=1S/C21H17N5O3/c1-14-6-4-7-15(12-14)19-25-20(29-26-19)16-8-2-3-9-17(16)28-13-18(27)24-21-22-10-5-11-23-21/h2-12H,13H2,1H3,(H,22,23,24,27)

InChI Key

QZTSZTYZKOKZMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27580450

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.402

Distribution Coefficient, logD

3.400

Water Solubility, LogSw

-3.84

Polar Surface Area

82.677

Acid Dissociation Constant (pKa)

9.81

Base Dissociation Constant (pKb)

-0.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

D349-0385 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with D349-0385 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D349-0385?
Check Price and Availability of D349-0385, 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 D349-0385 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D349-0385
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D349-0385
  • 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 D349-0385 available by request