8013-1559 Screening compound: N~1~-(5-bromo-8-quinolyl)-3-[(4-chlorophenyl)sulfonyl]-1-benzenesulfonamide

8013-1559 Screening compound: N~1~-(5-bromo-8-quinolyl)-3-[(4-chlorophenyl)sulfonyl]-1-benzenesulfonamide
8013-1559 Screening compound: N~1~-(5-bromo-8-quinolyl)-3-[(4-chlorophenyl)sulfonyl]-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-1559
N~1~-(5-bromo-8-quinolyl)-3-[(4-chlorophenyl)sulfonyl]-1-benzenesulfonamide

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

8013-1559

Molecular Formula

C21H14BrClN2O4S2 (C21 H14 BrClN2 O4 S2)

Compound Name

N~1~-(5-bromo-8-quinolyl)-3-[(4-chlorophenyl)sulfonyl]-1-benzenesulfonamide

IUPAC name

N-(5-bromoquinolin-8-yl)-3-(4-chlorobenzenesulfonyl)benzene-1-sulfonamide

SMILES

O=S(c(cc1)ccc1Cl)(c1cccc(S(Nc(c2ncccc22)ccc2Br)(=O)=O)c1)=O

InChI

InChI=1S/C21H14BrClN2O4S2/c22-19-10-11-20(21-18(19)5-2-12-24-21)25-31(28,29)17-4-1-3-16(13-17)30(26,27)15-8-6-14(23)7-9-15/h1-13,25H

InChI Key

FWMSNHMDUFAANQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03409402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.84

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.081

Distribution Coefficient, logD

4.572

Water Solubility, LogSw

-5.56

Polar Surface Area

79.224

Acid Dissociation Constant (pKa)

7.05

Base Dissociation Constant (pKb)

5.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8013-1559 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-1559?
Check Price and Availability of 8013-1559, 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 8013-1559 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-1559
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-1559
  • 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 8013-1559 available by request