6049-1705 Screening compound: 2-(5-methylfuran-2-yl)-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}quinoline

6049-1705 Screening compound: 2-(5-methylfuran-2-yl)-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}quinoline
6049-1705 Screening compound: 2-(5-methylfuran-2-yl)-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-1705
2-(5-methylfuran-2-yl)-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}quinoline

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

6049-1705

Molecular Formula

C26H22F3N3O2 (C26 H22 F3 N3 O2)

Compound Name

2-(5-methylfuran-2-yl)-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}quinoline

IUPAC name

2-(5-methylfuran-2-yl)-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}quinoline

SMILES

Cc1ccc(-c2nc3ccccc3c(C(N(CC3)CCN3c3cccc(C(F)(F)F)c3)=O)c2)o1

InChI

InChI=1S/C26H22F3N3O2/c1-17-9-10-24(34-17)23-16-21(20-7-2-3-8-22(20)30-23)25(33)32-13-11-31(12-14-32)19-6-4-5-18(15-19)26(27,28)29/h2-10,15-16H,11-14H2,1H3

InChI Key

AVNAVWCVFUTDAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03390084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.699

Distribution Coefficient, logD

5.699

Water Solubility, LogSw

-5.88

Polar Surface Area

36.299

Acid Dissociation Constant (pKa)

28.27

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

6049-1705 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 6049-1705 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-1705?
Check Price and Availability of 6049-1705, 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 6049-1705 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-1705
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-1705
  • 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 6049-1705 available by request