G504-0168 Screening compound: 3,4-difluoro-N-[1-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide

G504-0168 Screening compound: 3,4-difluoro-N-[1-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide
G504-0168 Screening compound: 3,4-difluoro-N-[1-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G504-0168
3,4-difluoro-N-[1-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]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

G504-0168

Molecular Formula

C22H17F3N2O3S (C22 H17 F3 N2 O3 S)

Compound Name

3,4-difluoro-N-[1-(4-fluorobenzenesulfonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide

IUPAC name

34-difluoro-N-[1-(4-fluorobenzenesulfonyl)-1234-tetrahydroquinolin-6-yl]benzamide

SMILES

O=C(c(cc1)cc(F)c1F)Nc(cc1)cc(CCC2)c1N2S(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C22H17F3N2O3S/c23-16-4-7-18(8-5-16)31(29,30)27-11-1-2-14-12-17(6-10-21(14)27)26-22(28)15-3-9-19(24)20(25)13-15/h3-10,12-13H,1-2,11H2,(H,26,28)

InChI Key

SXVOOIXHYFPEPF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08006784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.170

Distribution Coefficient, logD

4.159

Water Solubility, LogSw

-4.27

Polar Surface Area

54.482

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

-1.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

G504-0168 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G504-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G504-0168?
Check Price and Availability of G504-0168, 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 G504-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G504-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G504-0168
  • 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 G504-0168 available by request