1259-0053 Screening compound: quinolin-8-yl 4-ethylbenzene-1-sulfonate

1259-0053 Screening compound: quinolin-8-yl 4-ethylbenzene-1-sulfonate
1259-0053 Screening compound: quinolin-8-yl 4-ethylbenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1259-0053
quinolin-8-yl 4-ethylbenzene-1-sulfonate

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

1259-0053

Molecular Formula

C17H15NO3S (C17 H15 NO3 S)

Compound Name

quinolin-8-yl 4-ethylbenzene-1-sulfonate

IUPAC name

quinolin-8-yl 4-ethylbenzene-1-sulfonate

SMILES

CCc(cc1)ccc1S(Oc1cccc2cccnc12)(=O)=O

InChI

InChI=1S/C17H15NO3S/c1-2-13-8-10-15(11-9-13)22(19,20)21-16-7-3-5-14-6-4-12-18-17(14)16/h3-12H,2H2,1H3

InChI Key

HBNWYJQXIWGAFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00722165

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.898

Distribution Coefficient, logD

3.883

Water Solubility, LogSw

-3.76

Polar Surface Area

45.620

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

1259-0053 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1259-0053 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1259-0053?
Check Price and Availability of 1259-0053, 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 1259-0053 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1259-0053
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1259-0053
  • 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 1259-0053 available by request