8010-5981 Screening compound: 4-chloro-N-(2-chloro-1,2-diphenylethyl)benzene-1-sulfonamide

8010-5981 Screening compound: 4-chloro-N-(2-chloro-1,2-diphenylethyl)benzene-1-sulfonamide
8010-5981 Screening compound: 4-chloro-N-(2-chloro-1,2-diphenylethyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-5981
4-chloro-N-(2-chloro-1,2-diphenylethyl)benzene-1-sulfonamide

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

8010-5981

Molecular Formula

C20H17Cl2NO2S (C20 H17 Cl2 NO2 S)

Compound Name

4-chloro-N-(2-chloro-1,2-diphenylethyl)benzene-1-sulfonamide

IUPAC name

4-chloro-N-(2-chloro-12-diphenylethyl)benzene-1-sulfonamide

SMILES

O=S(c(cc1)ccc1Cl)(NC(C(c1ccccc1)Cl)c1ccccc1)=O

InChI

InChI=1S/C20H17Cl2NO2S/c21-17-11-13-18(14-12-17)26(24,25)23-20(16-9-5-2-6-10-16)19(22)15-7-3-1-4-8-15/h1-14,19-20,23H

InChI Key

OHHMWQSOGNTQQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02039565

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.900

Distribution Coefficient, logD

5.894

Water Solubility, LogSw

-6.39

Polar Surface Area

41.291

Acid Dissociation Constant (pKa)

9.30

Base Dissociation Constant (pKb)

-9.00

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

10.00

8010-5981 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 8010-5981 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-5981?
Check Price and Availability of 8010-5981, 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 8010-5981 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-5981
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-5981
  • 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 8010-5981 available by request