0896-8819 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-nitrobenzohydrazide

0896-8819 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-nitrobenzohydrazide
0896-8819 Screening compound: N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-nitrobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0896-8819
N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-nitrobenzohydrazide

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

0896-8819

Molecular Formula

C15H9BrN4O4 (C15 H9 BrN4 O4)

Compound Name

N'-[(3E)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-3-nitrobenzohydrazide

IUPAC name

N'-[(3E)-5-bromo-2-oxo-23-dihydro-1H-indol-3-ylidene]-3-nitrobenzohydrazide

SMILES

[O-][N+](c1cccc(C(N/N=C(\c(cc(cc2)Br)c2N2)/C2=O)=O)c1)=O

InChI

InChI=1S/C15H9BrN4O4/c16-9-4-5-12-11(7-9)13(15(22)17-12)18-19-14(21)8-2-1-3-10(6-8)20(23)24/h1-7H,(H,19,21)(H,17,18,22)

InChI Key

MFEYTBCGCCYJTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01427549

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.17

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.261

Distribution Coefficient, logD

1.607

Water Solubility, LogSw

-3.78

Polar Surface Area

92.746

Acid Dissociation Constant (pKa)

5.76

Base Dissociation Constant (pKb)

-0.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 0896-8819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0896-8819?
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What is the minimum amount of 0896-8819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0896-8819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0896-8819
  • 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 0896-8819 available by request