8006-1177 Screening compound: 4,6-dimethylbenzene-1,3-disulfonamide

8006-1177 Screening compound: 4,6-dimethylbenzene-1,3-disulfonamide
8006-1177 Screening compound: 4,6-dimethylbenzene-1,3-disulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-1177
4,6-dimethylbenzene-1,3-disulfonamide

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

8006-1177

Molecular Formula

C8H12N2O4S2 (C8 H12 N2 O4 S2)

Compound Name

4,6-dimethylbenzene-1,3-disulfonamide

IUPAC name

46-dimethylbenzene-13-disulfonamide

SMILES

Cc(c(S(N)(=O)=O)c1)cc(C)c1S(N)(=O)=O

InChI

InChI=1S/C8H12N2O4S2/c1-5-3-6(2)8(16(10,13)14)4-7(5)15(9,11)12/h3-4H,1-2H3,(H2,9,11,12)(H2,10,13,14)

InChI Key

ZNQJWUISJISGSX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00568792

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.33

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.287

Distribution Coefficient, logD

0.277

Water Solubility, LogSw

-1.54

Polar Surface Area

101.445

Acid Dissociation Constant (pKa)

9.04

Base Dissociation Constant (pKb)

-4.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8006-1177 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8006-1177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-1177?
Check Price and Availability of 8006-1177, 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 8006-1177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-1177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-1177
  • 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 8006-1177 available by request