C200-7458 Screening compound: 3-[(7-FLUORO-4-OXO-1,4-DIHYDROQUINOLIN-3-YL)SULFONYL]BENZONITRILE

C200-7458 Screening compound: 3-[(7-FLUORO-4-OXO-1,4-DIHYDROQUINOLIN-3-YL)SULFONYL]BENZONITRILE
C200-7458 Screening compound: 3-[(7-FLUORO-4-OXO-1,4-DIHYDROQUINOLIN-3-YL)SULFONYL]BENZONITRILE alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-7458
3-[(7-FLUORO-4-OXO-1,4-DIHYDROQUINOLIN-3-YL)SULFONYL]BENZONITRILE

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

C200-7458

Molecular Formula

C16H9FN2O3S (C16 H9 FN2 O3 S)

Compound Name

3-[(7-FLUORO-4-OXO-1,4-DIHYDROQUINOLIN-3-YL)SULFONYL]BENZONITRILE

IUPAC name

n/a

SMILES

N#Cc1cccc(S(C2=CNc(cc(cc3)F)c3C2=O)(=O)=O)c1

InChI

InChI=1S/C16H9FN2O3S/c17-11-4-5-13-14(7-11)19-9-15(16(13)20)23(21,22)12-3-1-2-10(6-12)8-18/h1-7,9H,(H,19,20)

InChI Key

ADKWKPXVGSKQLK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14728518

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.272

Distribution Coefficient, logD

2.172

Water Solubility, LogSw

-3.10

Polar Surface Area

70.915

Acid Dissociation Constant (pKa)

7.99

Base Dissociation Constant (pKb)

-5.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

C200-7458 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C200-7458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-7458?
Check Price and Availability of C200-7458, 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 C200-7458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-7458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-7458
  • 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 C200-7458 available by request