C749-0166 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine

C749-0166 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine
C749-0166 Screening compound: N-[2-(4-chlorophenyl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C749-0166
N-[2-(4-chlorophenyl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine

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

C749-0166

Molecular Formula

C17H16ClN3O2 (C17 H16 ClN3 O2)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-amine

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-3-(4-methoxyphenyl)-124-oxadiazol-5-amine

SMILES

COc(cc1)ccc1-c1noc(NCCc(cc2)ccc2Cl)n1

InChI

InChI=1S/C17H16ClN3O2/c1-22-15-8-4-13(5-9-15)16-20-17(23-21-16)19-11-10-12-2-6-14(18)7-3-12/h2-9H,10-11H2,1H3,(H,19,20,21)

InChI Key

UMSHGNRDIDDNHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14791548

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.79

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.358

Distribution Coefficient, logD

4.358

Water Solubility, LogSw

-4.63

Polar Surface Area

50.848

Acid Dissociation Constant (pKa)

18.69

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

C749-0166 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C749-0166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C749-0166?
Check Price and Availability of C749-0166, 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 C749-0166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C749-0166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C749-0166
  • 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 C749-0166 available by request