1207-0198 Screening compound: (5E)-5-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-1,3-thiazolidine-2,4-dione

1207-0198 Screening compound: (5E)-5-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-1,3-thiazolidine-2,4-dione
1207-0198 Screening compound: (5E)-5-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-1,3-thiazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1207-0198
(5E)-5-{[4-(benzyloxy)-3-ethoxyphenyl]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

1207-0198

Molecular Formula

C19H17NO4S (C19 H17 NO4 S)

Compound Name

(5E)-5-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-1,3-thiazolidine-2,4-dione

IUPAC name

(5E)-5-{[4-(benzyloxy)-3-ethoxyphenyl]methylidene}-13-thiazolidine-24-dione

SMILES

CCOc(cc(/C=C(\C(N1)=O)/SC1=O)cc1)c1OCc1ccccc1

InChI

InChI=1S/C19H17NO4S/c1-2-23-16-10-14(11-17-18(21)20-19(22)25-17)8-9-15(16)24-12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H,20,21,22)

InChI Key

MRFDRKDSYGMQTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01244927

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.813

Distribution Coefficient, logD

2.779

Water Solubility, LogSw

-3.35

Polar Surface Area

52.433

Acid Dissociation Constant (pKa)

8.49

Base Dissociation Constant (pKb)

-2.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

1207-0198 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 1207-0198 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1207-0198?
Check Price and Availability of 1207-0198, 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 1207-0198 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1207-0198
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1207-0198
  • 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 1207-0198 available by request