4456-0756 Screening compound: 1-(4-chlorobenzenesulfonyl)-4-(2-methoxyphenyl)piperazine

4456-0756 Screening compound: 1-(4-chlorobenzenesulfonyl)-4-(2-methoxyphenyl)piperazine
4456-0756 Screening compound: 1-(4-chlorobenzenesulfonyl)-4-(2-methoxyphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4456-0756
1-(4-chlorobenzenesulfonyl)-4-(2-methoxyphenyl)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

4456-0756

Molecular Formula

C17H19ClN2O3S (C17 H19 ClN2 O3 S)

Compound Name

1-(4-chlorobenzenesulfonyl)-4-(2-methoxyphenyl)piperazine

IUPAC name

1-(4-chlorobenzenesulfonyl)-4-(2-methoxyphenyl)piperazine

SMILES

COc(cccc1)c1N(CC1)CCN1S(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C17H19ClN2O3S/c1-23-17-5-3-2-4-16(17)19-10-12-20(13-11-19)24(21,22)15-8-6-14(18)7-9-15/h2-9H,10-13H2,1H3

InChI Key

WTXZSPLQEKAFCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00592925

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.87

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.604

Distribution Coefficient, logD

3.604

Water Solubility, LogSw

-3.92

Polar Surface Area

42.539

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

5.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

4456-0756 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 4456-0756 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4456-0756?
Check Price and Availability of 4456-0756, 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 4456-0756 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4456-0756
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4456-0756
  • 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 4456-0756 available by request