8009-2836 Screening compound: N~1~-[1-(4-bromophenyl)-2,2,2-trichloroethyl]-1-benzenesulfonamide

8009-2836 Screening compound: N~1~-[1-(4-bromophenyl)-2,2,2-trichloroethyl]-1-benzenesulfonamide
8009-2836 Screening compound: N~1~-[1-(4-bromophenyl)-2,2,2-trichloroethyl]-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-2836
N~1~-[1-(4-bromophenyl)-2,2,2-trichloroethyl]-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

8009-2836

Molecular Formula

C14H11BrCl3NO2S (C14 H11 BrCl3 NO2 S)

Compound Name

N~1~-[1-(4-bromophenyl)-2,2,2-trichloroethyl]-1-benzenesulfonamide

IUPAC name

N-[1-(4-bromophenyl)-222-trichloroethyl]benzenesulfonamide

SMILES

O=S(c1ccccc1)(NC(C(Cl)(Cl)Cl)c(cc1)ccc1Br)=O

InChI

InChI=1S/C14H11BrCl3NO2S/c15-11-8-6-10(7-9-11)13(14(16,17)18)19-22(20,21)12-4-2-1-3-5-12/h1-9,13,19H/t13-/m1/s1

InChI Key

HCPJJJZLHGDBKR-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD01572810

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.186

Distribution Coefficient, logD

3.523

Water Solubility, LogSw

-6.00

Polar Surface Area

41.562

Acid Dissociation Constant (pKa)

5.75

Base Dissociation Constant (pKb)

-12.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.29

8009-2836 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8009-2836 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-2836?
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What is the minimum amount of 8009-2836 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-2836
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-2836
  • 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 8009-2836 available by request