6049-2995 Screening compound: 2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxylic acid

6049-2995 Screening compound: 2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxylic acid
6049-2995 Screening compound: 2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-2995
2-[3-(2-methylpropoxy)phenyl]quinoline-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

6049-2995

Molecular Formula

C20H19NO3 (C20 H19 NO3)

Compound Name

2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxylic acid

IUPAC name

2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxylic acid

SMILES

CC(C)COc1cccc(-c2nc3ccccc3c(C(O)=O)c2)c1

InChI

InChI=1S/C20H19NO3/c1-13(2)12-24-15-7-5-6-14(10-15)19-11-17(20(22)23)16-8-3-4-9-18(16)21-19/h3-11,13H,12H2,1-2H3,(H,22,23)

InChI Key

UDFSACYGNPAQCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01993647

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.577

Distribution Coefficient, logD

0.522

Water Solubility, LogSw

-5.55

Polar Surface Area

44.205

Acid Dissociation Constant (pKa)

2.94

Base Dissociation Constant (pKb)

4.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

6049-2995 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Library (67538 compounds)

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 6049-2995 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-2995?
Check Price and Availability of 6049-2995, 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 6049-2995 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-2995
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-2995
  • 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 6049-2995 available by request