D109-0060 Screening compound: 2-(4-chloro-3,5-dimethylphenoxy)-N-(4-methyl-1,2,5-oxadiazol-3-yl)propanamide

D109-0060 Screening compound: 2-(4-chloro-3,5-dimethylphenoxy)-N-(4-methyl-1,2,5-oxadiazol-3-yl)propanamide
D109-0060 Screening compound: 2-(4-chloro-3,5-dimethylphenoxy)-N-(4-methyl-1,2,5-oxadiazol-3-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D109-0060
2-(4-chloro-3,5-dimethylphenoxy)-N-(4-methyl-1,2,5-oxadiazol-3-yl)propanamide

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

D109-0060

Molecular Formula

C14H16ClN3O3 (C14 H16 ClN3 O3)

Compound Name

2-(4-chloro-3,5-dimethylphenoxy)-N-(4-methyl-1,2,5-oxadiazol-3-yl)propanamide

IUPAC name

2-(4-chloro-35-dimethylphenoxy)-N-(4-methyl-125-oxadiazol-3-yl)propanamide

SMILES

CC(C(Nc1nonc1C)=O)Oc(cc1C)cc(C)c1Cl

InChI

InChI=1S/C14H16ClN3O3/c1-7-5-11(6-8(2)12(7)15)20-10(4)14(19)16-13-9(3)17-21-18-13/h5-6,10H,1-4H3,(H,16,18,19)/t10-/m0/s1

InChI Key

JVQXNHDZFILDMV-JTQLQIEISA-N

MDL Number (MFCD)

MFCD12917318

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.75

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.857

Distribution Coefficient, logD

3.836

Water Solubility, LogSw

-4.47

Polar Surface Area

66.953

Acid Dissociation Constant (pKa)

8.71

Base Dissociation Constant (pKb)

-4.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

D109-0060 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Kinases
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D109-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D109-0060?
Check Price and Availability of D109-0060, 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 D109-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D109-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D109-0060
  • 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 D109-0060 available by request