1543-0092 Screening compound: (5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione

1543-0092 Screening compound: (5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione
1543-0092 Screening compound: (5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1543-0092
(5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione

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

1543-0092

Molecular Formula

C10H6N2O5S (C10 H6 N2 O5 S)

Compound Name

(5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-1,3-thiazolidine-2,4-dione

IUPAC name

(5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-13-thiazolidine-24-dione

SMILES

[O-][N+](c(cc(/C=C(\C(N1)=O)/SC1=O)cc1)c1O)=O

InChI

InChI=1S/C10H6N2O5S/c13-7-2-1-5(3-6(7)12(16)17)4-8-9(14)11-10(15)18-8/h1-4,13H,(H,11,14,15)

InChI Key

CNQAUUWTCOSDSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00849585

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

266.23

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.330

Distribution Coefficient, logD

0.537

Water Solubility, LogSw

-2.31

Polar Surface Area

87.537

Acid Dissociation Constant (pKa)

6.68

Base Dissociation Constant (pKb)

-2.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1543-0092 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1543-0092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1543-0092?
Check Price and Availability of 1543-0092, 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 1543-0092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1543-0092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1543-0092
  • 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 1543-0092 available by request