6049-2249 Screening compound: 2-(4-butoxyphenyl)-3-methylquinoline-4-carboxylic acid

6049-2249 Screening compound: 2-(4-butoxyphenyl)-3-methylquinoline-4-carboxylic acid
6049-2249 Screening compound: 2-(4-butoxyphenyl)-3-methylquinoline-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-2249
2-(4-butoxyphenyl)-3-methylquinoline-4-carboxylic acid

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

6049-2249

Molecular Formula

C21H21NO3 (C21 H21 NO3)

Compound Name

2-(4-butoxyphenyl)-3-methylquinoline-4-carboxylic acid

IUPAC name

2-(4-butoxyphenyl)-3-methylquinoline-4-carboxylic acid

SMILES

CCCCOc(cc1)ccc1-c1nc2ccccc2c(C(O)=O)c1C

InChI

InChI=1S/C21H21NO3/c1-3-4-13-25-16-11-9-15(10-12-16)20-14(2)19(21(23)24)17-7-5-6-8-18(17)22-20/h5-12H,3-4,13H2,1-2H3,(H,23,24)

InChI Key

DYLOMYCPVCVWBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02090824

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

335.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.321

Distribution Coefficient, logD

0.288

Water Solubility, LogSw

-5.25

Polar Surface Area

44.894

Acid Dissociation Constant (pKa)

2.96

Base Dissociation Constant (pKb)

3.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

6049-2249 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Antiviral Library (67538 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Akt-Targeted Library (14764 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Agro:
  • Agro
Targets:
  • Nuclear receptors
  • Kinases

References: we are preparing a list of scientific research reports with 6049-2249 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-2249?
Check Price and Availability of 6049-2249, 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 6049-2249 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-2249
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-2249
  • 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 6049-2249 available by request