4515-0358 Screening compound: 2-(2,4-dioxo-1,3-thiazolidin-5-yl)-N-{2-[2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetamido]phenyl}acetamide

4515-0358 Screening compound: 2-(2,4-dioxo-1,3-thiazolidin-5-yl)-N-{2-[2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetamido]phenyl}acetamide
4515-0358 Screening compound: 2-(2,4-dioxo-1,3-thiazolidin-5-yl)-N-{2-[2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetamido]phenyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4515-0358
2-(2,4-dioxo-1,3-thiazolidin-5-yl)-N-{2-[2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetamido]phenyl}acetamide

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

4515-0358

Molecular Formula

C16H14N4O6S2 (C16 H14 N4 O6 S2)

Compound Name

2-(2,4-dioxo-1,3-thiazolidin-5-yl)-N-{2-[2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetamido]phenyl}acetamide

IUPAC name

2-(24-dioxo-13-thiazolidin-5-yl)-N-{2-[2-(24-dioxo-13-thiazolidin-5-yl)acetamido]phenyl}acetamide

SMILES

O=C(CC(C(N1)=O)SC1=O)Nc(cccc1)c1NC(CC(C(N1)=O)SC1=O)=O

InChI

InChI=1S/C16H14N4O6S2/c21-11(5-9-13(23)19-15(25)27-9)17-7-3-1-2-4-8(7)18-12(22)6-10-14(24)20-16(26)28-10/h1-4,9-10H,5-6H2,(H,17,21)(H,18,22)(H,19,23,25)(H,20,24,26)

InChI Key

AMUIADUYFTXQBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02331451

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.44

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.452

Distribution Coefficient, logD

-0.958

Water Solubility, LogSw

-1.82

Polar Surface Area

120.481

Acid Dissociation Constant (pKa)

7.06

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

25.00

4515-0358 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4515-0358 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4515-0358?
Check Price and Availability of 4515-0358, 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 4515-0358 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4515-0358
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4515-0358
  • 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 4515-0358 available by request