8004-0854 Screening compound: N'-[(3Z)-5,7-dibromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(3-nitrophenoxy)acetohydrazide

8004-0854 Screening compound: N'-[(3Z)-5,7-dibromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(3-nitrophenoxy)acetohydrazide
8004-0854 Screening compound: N'-[(3Z)-5,7-dibromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(3-nitrophenoxy)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-0854
N'-[(3Z)-5,7-dibromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(3-nitrophenoxy)acetohydrazide

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

8004-0854

Molecular Formula

C16H10Br2N4O5 (C16 H10 Br2 N4 O5)

Compound Name

N'-[(3Z)-5,7-dibromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-(3-nitrophenoxy)acetohydrazide

IUPAC name

N'-[(3Z)-57-dibromo-2-oxo-23-dihydro-1H-indol-3-ylidene]-2-(3-nitrophenoxy)acetohydrazide

SMILES

[O-][N+](c1cccc(OCC(N/N=C(/c2cc(Br)cc(Br)c2N2)\C2=O)=O)c1)=O

InChI

InChI=1S/C16H10Br2N4O5/c17-8-4-11-14(12(18)5-8)19-16(24)15(11)21-20-13(23)7-27-10-3-1-2-9(6-10)22(25)26/h1-6H,7H2,(H,20,23)(H,19,21,24)

InChI Key

NXNXYOGTACIGGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00362711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.09

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.630

Distribution Coefficient, logD

3.334

Water Solubility, LogSw

-4.04

Polar Surface Area

97.779

Acid Dissociation Constant (pKa)

7.41

Base Dissociation Constant (pKb)

-2.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

References: we are preparing a list of scientific research reports with 8004-0854 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-0854?
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What is the minimum amount of 8004-0854 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-0854
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-0854
  • 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 8004-0854 available by request