8412-2059 Screening compound: 1-(5-chloro-2-methoxybenzenesulfonyl)-1H-imidazole

8412-2059 Screening compound: 1-(5-chloro-2-methoxybenzenesulfonyl)-1H-imidazole
8412-2059 Screening compound: 1-(5-chloro-2-methoxybenzenesulfonyl)-1H-imidazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8412-2059
1-(5-chloro-2-methoxybenzenesulfonyl)-1H-imidazole

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

8412-2059

Molecular Formula

C10H9ClN2O3S (C10 H9 ClN2 O3 S)

Compound Name

1-(5-chloro-2-methoxybenzenesulfonyl)-1H-imidazole

IUPAC name

1-(5-chloro-2-methoxybenzenesulfonyl)-1H-imidazole

SMILES

COc(ccc(Cl)c1)c1S(n1cncc1)(=O)=O

InChI

InChI=1S/C10H9ClN2O3S/c1-16-9-3-2-8(11)6-10(9)17(14,15)13-5-4-12-7-13/h2-7H,1H3

InChI Key

JIRLOFLEWSPHLK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02043718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

272.71

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.220

Distribution Coefficient, logD

1.220

Water Solubility, LogSw

-2.52

Polar Surface Area

48.554

Acid Dissociation Constant (pKa)

32.90

Base Dissociation Constant (pKb)

1.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

8412-2059 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8412-2059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8412-2059?
Check Price and Availability of 8412-2059, 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 8412-2059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8412-2059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8412-2059
  • 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 8412-2059 available by request