0075-0116 Screening compound: 4-chloro-N-[(2Z)-3-(4-chlorobenzenesulfonyl)-1,3-thiazolidin-2-ylidene]benzene-1-sulfonamide

0075-0116 Screening compound: 4-chloro-N-[(2Z)-3-(4-chlorobenzenesulfonyl)-1,3-thiazolidin-2-ylidene]benzene-1-sulfonamide
0075-0116 Screening compound: 4-chloro-N-[(2Z)-3-(4-chlorobenzenesulfonyl)-1,3-thiazolidin-2-ylidene]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0075-0116
4-chloro-N-[(2Z)-3-(4-chlorobenzenesulfonyl)-1,3-thiazolidin-2-ylidene]benzene-1-sulfonamide

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

0075-0116

Molecular Formula

C15H12Cl2N2O4S3 (C15 H12 Cl2 N2 O4 S3)

Compound Name

4-chloro-N-[(2Z)-3-(4-chlorobenzenesulfonyl)-1,3-thiazolidin-2-ylidene]benzene-1-sulfonamide

IUPAC name

4-chloro-N-[(2Z)-3-(4-chlorobenzenesulfonyl)-13-thiazolidin-2-ylidene]benzene-1-sulfonamide

SMILES

O=S(c(cc1)ccc1Cl)(N(CCS1)/C1=N/S(c(cc1)ccc1Cl)(=O)=O)=O

InChI

InChI=1S/C15H12Cl2N2O4S3/c16-11-1-5-13(6-2-11)25(20,21)18-15-19(9-10-24-15)26(22,23)14-7-3-12(17)4-8-14/h1-8H,9-10H2

InChI Key

WDIJZQORKGIPPO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00227086

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.37

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.640

Distribution Coefficient, logD

3.640

Water Solubility, LogSw

-3.99

Polar Surface Area

72.666

Acid Dissociation Constant (pKa)

31.62

Base Dissociation Constant (pKb)

-4.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

0075-0116 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0075-0116 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0075-0116?
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What is the minimum amount of 0075-0116 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0075-0116
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0075-0116
  • 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 0075-0116 available by request