1588-0074 Screening compound: (5E)-5-[(2-methoxy-5-nitrophenyl)methylidene]-3-phenyl-1,3-thiazolidine-2,4-dione

1588-0074 Screening compound: (5E)-5-[(2-methoxy-5-nitrophenyl)methylidene]-3-phenyl-1,3-thiazolidine-2,4-dione
1588-0074 Screening compound: (5E)-5-[(2-methoxy-5-nitrophenyl)methylidene]-3-phenyl-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1588-0074
(5E)-5-[(2-methoxy-5-nitrophenyl)methylidene]-3-phenyl-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

1588-0074

Molecular Formula

C17H12N2O5S (C17 H12 N2 O5 S)

Compound Name

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

IUPAC name

(5E)-5-[(2-methoxy-5-nitrophenyl)methylidene]-3-phenyl-13-thiazolidine-24-dione

SMILES

COc(cc1)c(/C=C(\C(N2c3ccccc3)=O)/SC2=O)cc1[N+]([O-])=O

InChI

InChI=1S/C17H12N2O5S/c1-24-14-8-7-13(19(22)23)9-11(14)10-15-16(20)18(17(21)25-15)12-5-3-2-4-6-12/h2-10H,1H3

InChI Key

LGOXKXXUCBKYAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01021876

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.36

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.802

Distribution Coefficient, logD

3.802

Water Solubility, LogSw

-4.01

Polar Surface Area

69.996

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

References: we are preparing a list of scientific research reports with 1588-0074 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1588-0074?
Check Price and Availability of 1588-0074, 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 1588-0074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1588-0074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1588-0074
  • 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 1588-0074 available by request