3324-0629 Screening compound: 5-bromo-3-[(5Z)-2-[(4-bromophenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one

3324-0629 Screening compound: 5-bromo-3-[(5Z)-2-[(4-bromophenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one
3324-0629 Screening compound: 5-bromo-3-[(5Z)-2-[(4-bromophenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3324-0629
5-bromo-3-[(5Z)-2-[(4-bromophenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one

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

3324-0629

Molecular Formula

C17H9Br2N3O2S (C17 H9 Br2 N3 O2 S)

Compound Name

5-bromo-3-[(5Z)-2-[(4-bromophenyl)amino]-4-oxo-4,5-dihydro-1,3-thiazol-5-ylidene]-2,3-dihydro-1H-indol-2-one

IUPAC name

5-bromo-3-[(5Z)-2-[(4-bromophenyl)amino]-4-oxo-45-dihydro-13-thiazol-5-ylidene]-23-dihydro-1H-indol-2-one

SMILES

O=C1Nc(ccc(Br)c2)c2/C1=C1/SC(Nc(cc2)ccc2Br)=NC1=O

InChI

InChI=1S/C17H9Br2N3O2S/c18-8-1-4-10(5-2-8)20-17-22-16(24)14(25-17)13-11-7-9(19)3-6-12(11)21-15(13)23/h1-7H,(H,21,23)(H,20,22,24)

InChI Key

OTGBYQNTYGUXTG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02328571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.15

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.610

Distribution Coefficient, logD

4.525

Water Solubility, LogSw

-4.48

Polar Surface Area

56.868

Acid Dissociation Constant (pKa)

8.07

Base Dissociation Constant (pKb)

0.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 3324-0629 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3324-0629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3324-0629
  • 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 3324-0629 available by request