4343-0062 Screening compound: butyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

4343-0062 Screening compound: butyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate
4343-0062 Screening compound: butyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4343-0062
butyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

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

4343-0062

Molecular Formula

C22H23NO2 (C22 H23 NO2)

Compound Name

butyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

IUPAC name

butyl 8-methyl-2-(4-methylphenyl)quinoline-4-carboxylate

SMILES

CCCCOC(c1cc(-c2ccc(C)cc2)nc2c(C)cccc12)=O

InChI

InChI=1S/C22H23NO2/c1-4-5-13-25-22(24)19-14-20(17-11-9-15(2)10-12-17)23-21-16(3)7-6-8-18(19)21/h6-12,14H,4-5,13H2,1-3H3

InChI Key

GRSHCFCQJRWGAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02862784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.040

Distribution Coefficient, logD

6.996

Water Solubility, LogSw

-5.90

Polar Surface Area

30.116

Acid Dissociation Constant (pKa)

23.92

Base Dissociation Constant (pKb)

6.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

4343-0062 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4343-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4343-0062?
Check Price and Availability of 4343-0062, 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 4343-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4343-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4343-0062
  • 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 4343-0062 available by request