4440-0246 Screening compound: 1,4-bis(4-chloro-2-methoxybenzenesulfonyl)piperazine

4440-0246 Screening compound: 1,4-bis(4-chloro-2-methoxybenzenesulfonyl)piperazine
4440-0246 Screening compound: 1,4-bis(4-chloro-2-methoxybenzenesulfonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4440-0246
1,4-bis(4-chloro-2-methoxybenzenesulfonyl)piperazine

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

4440-0246

Molecular Formula

C18H20Cl2N2O6S2 (C18 H20 Cl2 N2 O6 S2)

Compound Name

1,4-bis(4-chloro-2-methoxybenzenesulfonyl)piperazine

IUPAC name

14-bis(4-chloro-2-methoxybenzenesulfonyl)piperazine

SMILES

COc(cc(cc1)Cl)c1S(N(CC1)CCN1S(c(ccc(Cl)c1)c1OC)(=O)=O)(=O)=O

InChI

InChI=1S/C18H20Cl2N2O6S2/c1-27-15-11-13(19)3-5-17(15)29(23,24)21-7-9-22(10-8-21)30(25,26)18-6-4-14(20)12-16(18)28-2/h3-6,11-12H,7-10H2,1-2H3

InChI Key

SLJBYLIVNMTPFF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02920405

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.4

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.821

Distribution Coefficient, logD

3.821

Water Solubility, LogSw

-4.32

Polar Surface Area

78.729

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-7.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

4440-0246 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 4440-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4440-0246?
Check Price and Availability of 4440-0246, 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 4440-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4440-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4440-0246
  • 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 4440-0246 available by request