6049-2808 Screening compound: N-(5-bromoquinolin-8-yl)-3-[(2,2,3,3-tetrafluoropropoxy)methyl]benzamide

6049-2808 Screening compound: N-(5-bromoquinolin-8-yl)-3-[(2,2,3,3-tetrafluoropropoxy)methyl]benzamide
6049-2808 Screening compound: N-(5-bromoquinolin-8-yl)-3-[(2,2,3,3-tetrafluoropropoxy)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-2808
N-(5-bromoquinolin-8-yl)-3-[(2,2,3,3-tetrafluoropropoxy)methyl]benzamide

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

6049-2808

Molecular Formula

C20H15BrF4N2O2 (C20 H15 BrF4 N2 O2)

Compound Name

N-(5-bromoquinolin-8-yl)-3-[(2,2,3,3-tetrafluoropropoxy)methyl]benzamide

IUPAC name

N-(5-bromoquinolin-8-yl)-3-[(2233-tetrafluoropropoxy)methyl]benzamide

SMILES

O=C(c1cc(COCC(C(F)F)(F)F)ccc1)Nc(c1ncccc11)ccc1Br

InChI

InChI=1S/C20H15BrF4N2O2/c21-15-6-7-16(17-14(15)5-2-8-26-17)27-18(28)13-4-1-3-12(9-13)10-29-11-20(24,25)19(22)23/h1-9,19H,10-11H2,(H,27,28)

InChI Key

YKKSULUUGOSIKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02175610

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.708

Distribution Coefficient, logD

4.695

Water Solubility, LogSw

-4.99

Polar Surface Area

40.599

Acid Dissociation Constant (pKa)

8.92

Base Dissociation Constant (pKb)

3.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

6049-2808 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 6049-2808 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-2808?
Check Price and Availability of 6049-2808, 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 6049-2808 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-2808
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-2808
  • 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 6049-2808 available by request