C521-2105 Screening compound: 1-{5-[(2,6-dichlorobenzenesulfonyl)methyl]furan-2-carbonyl}-4-(pyridin-2-yl)piperazine

C521-2105 Screening compound: 1-{5-[(2,6-dichlorobenzenesulfonyl)methyl]furan-2-carbonyl}-4-(pyridin-2-yl)piperazine
C521-2105 Screening compound: 1-{5-[(2,6-dichlorobenzenesulfonyl)methyl]furan-2-carbonyl}-4-(pyridin-2-yl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C521-2105
1-{5-[(2,6-dichlorobenzenesulfonyl)methyl]furan-2-carbonyl}-4-(pyridin-2-yl)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

C521-2105

Molecular Formula

C21H19Cl2N3O4S (C21 H19 Cl2 N3 O4 S)

Compound Name

1-{5-[(2,6-dichlorobenzenesulfonyl)methyl]furan-2-carbonyl}-4-(pyridin-2-yl)piperazine

IUPAC name

1-{5-[(26-dichlorobenzenesulfonyl)methyl]furan-2-carbonyl}-4-(pyridin-2-yl)piperazine

SMILES

O=C(c1ccc(CS(c(c(Cl)ccc2)c2Cl)(=O)=O)o1)N(CC1)CCN1c1ncccc1

InChI

InChI=1S/C21H19Cl2N3O4S/c22-16-4-3-5-17(23)20(16)31(28,29)14-15-7-8-18(30-15)21(27)26-12-10-25(11-13-26)19-6-1-2-9-24-19/h1-9H,10-14H2

InChI Key

CPHHDYABKKGHQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14765580

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.813

Distribution Coefficient, logD

3.804

Water Solubility, LogSw

-4.12

Polar Surface Area

65.264

Acid Dissociation Constant (pKa)

24.13

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

C521-2105 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C521-2105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C521-2105?
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What is the minimum amount of C521-2105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C521-2105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C521-2105
  • 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 C521-2105 available by request