2798-0632 Screening compound: N-[(5Z)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]-2,2-diphenylacetamide

2798-0632 Screening compound: N-[(5Z)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]-2,2-diphenylacetamide
2798-0632 Screening compound: N-[(5Z)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]-2,2-diphenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2798-0632
N-[(5Z)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]-2,2-diphenylacetamide

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

2798-0632

Molecular Formula

C22H16N2O2S3 (C22 H16 N2 O2 S3)

Compound Name

N-[(5Z)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]-2,2-diphenylacetamide

IUPAC name

N-[(5Z)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-13-thiazolidin-3-yl]-22-diphenylacetamide

SMILES

O=C(C(c1ccccc1)c1ccccc1)NN(C(/C(/S1)=C/c2cccs2)=O)C1=S

InChI

InChI=1S/C22H16N2O2S3/c25-20(19(15-8-3-1-4-9-15)16-10-5-2-6-11-16)23-24-21(26)18(29-22(24)27)14-17-12-7-13-28-17/h1-14,19H,(H,23,25)

InChI Key

CXOKUAZKWIZFQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01911727

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.660

Distribution Coefficient, logD

4.634

Water Solubility, LogSw

-4.74

Polar Surface Area

43.590

Acid Dissociation Constant (pKa)

8.61

Base Dissociation Constant (pKb)

-14.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

2798-0632 in Drug Discovery

Included in Screening Libraries

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

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 2798-0632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2798-0632?
Check Price and Availability of 2798-0632, 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 2798-0632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2798-0632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2798-0632
  • 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 2798-0632 available by request