3323-0089 Screening compound: 2-bromo-N-{4-oxo-5-[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide

3323-0089 Screening compound: 2-bromo-N-{4-oxo-5-[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide
3323-0089 Screening compound: 2-bromo-N-{4-oxo-5-[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3323-0089
2-bromo-N-{4-oxo-5-[(3Z)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl}benzamide

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

3323-0089

Molecular Formula

C18H10BrN3O3S2 (C18 H10 BrN3 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

O=C(c(cccc1)c1Br)NN(C(/C(/S1)=C(\c(cccc2)c2N2)/C2=O)=O)C1=S

InChI

InChI=1S/C18H10BrN3O3S2/c19-11-7-3-1-5-9(11)15(23)21-22-17(25)14(27-18(22)26)13-10-6-2-4-8-12(10)20-16(13)24/h1-8H,(H,20,24)(H,21,23)

InChI Key

ITNOGPGJFRPCEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01946821

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.33

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.445

Distribution Coefficient, logD

1.608

Water Solubility, LogSw

-3.05

Polar Surface Area

68.087

Acid Dissociation Constant (pKa)

6.63

Base Dissociation Constant (pKb)

-0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3323-0089 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Regenerative Medicine Focused Library (23016 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3323-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3323-0089?
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What is the minimum amount of 3323-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3323-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3323-0089
  • 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 3323-0089 available by request