8016-3458 Screening compound: 2-methoxy-4-[3-(2-methyl-4-quinolyl)-1,2,4-oxadiazol-5-yl]phenyl methyl ether

8016-3458 Screening compound: 2-methoxy-4-[3-(2-methyl-4-quinolyl)-1,2,4-oxadiazol-5-yl]phenyl methyl ether
8016-3458 Screening compound: 2-methoxy-4-[3-(2-methyl-4-quinolyl)-1,2,4-oxadiazol-5-yl]phenyl methyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-3458
2-methoxy-4-[3-(2-methyl-4-quinolyl)-1,2,4-oxadiazol-5-yl]phenyl methyl ether

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

8016-3458

Molecular Formula

C20H17N3O3 (C20 H17 N3 O3)

Compound Name

2-methoxy-4-[3-(2-methyl-4-quinolyl)-1,2,4-oxadiazol-5-yl]phenyl methyl ether

IUPAC name

4-[5-(34-dimethoxyphenyl)-124-oxadiazol-3-yl]-2-methylquinoline

SMILES

Cc1nc2ccccc2c(-c2noc(-c(cc3)cc(OC)c3OC)n2)c1

InChI

InChI=1S/C20H17N3O3/c1-12-10-15(14-6-4-5-7-16(14)21-12)19-22-20(26-23-19)13-8-9-17(24-2)18(11-13)25-3/h4-11H,1-3H3

InChI Key

OTMQLAGTRPRTNH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05855615

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.000

Distribution Coefficient, logD

4.000

Water Solubility, LogSw

-4.16

Polar Surface Area

55.042

Acid Dissociation Constant (pKa)

28.08

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

8016-3458 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8016-3458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-3458?
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What is the minimum amount of 8016-3458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-3458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-3458
  • 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 8016-3458 available by request