2279-4990 Screening compound: N-{5-[(3Z)-1-benzyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}pyridine-4-carboxamide

2279-4990 Screening compound: N-{5-[(3Z)-1-benzyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}pyridine-4-carboxamide
2279-4990 Screening compound: N-{5-[(3Z)-1-benzyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}pyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2279-4990
N-{5-[(3Z)-1-benzyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}pyridine-4-carboxamide

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

2279-4990

Molecular Formula

C24H16N4O3S2 (C24 H16 N4 O3 S2)

Compound Name

N-{5-[(3Z)-1-benzyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}pyridine-4-carboxamide

IUPAC name

N-{5-[(3Z)-1-benzyl-2-oxo-23-dihydro-1H-indol-3-ylidene]-4-oxo-2-sulfanylidene-13-thiazolidin-3-yl}pyridine-4-carboxamide

SMILES

O=C(c1ccncc1)NN(C(/C(/S1)=C(\c(cccc2)c2N2Cc3ccccc3)/C2=O)=O)C1=S

InChI

InChI=1S/C24H16N4O3S2/c29-21(16-10-12-25-13-11-16)26-28-23(31)20(33-24(28)32)19-17-8-4-5-9-18(17)27(22(19)30)14-15-6-2-1-3-7-15/h1-13H,14H2,(H,26,29)

InChI Key

NLUQMCXWEPTESY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01847350

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.790

Distribution Coefficient, logD

2.128

Water Solubility, LogSw

-3.54

Polar Surface Area

67.741

Acid Dissociation Constant (pKa)

6.84

Base Dissociation Constant (pKb)

3.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

2279-4990 in Drug Discovery

Included in Screening Libraries

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 2279-4990 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2279-4990?
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What is the minimum amount of 2279-4990 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2279-4990
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2279-4990
  • 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 2279-4990 available by request