8008-1467 Screening compound: 4-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]phenyl 3,5-dinitrobenzoate

8008-1467 Screening compound: 4-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]phenyl 3,5-dinitrobenzoate
8008-1467 Screening compound: 4-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]phenyl 3,5-dinitrobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-1467
4-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]phenyl 3,5-dinitrobenzoate

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

8008-1467

Molecular Formula

C20H12N6O10 (C20 H12 N6 O10)

Compound Name

4-[(E)-[2-(2,4-dinitrophenyl)hydrazin-1-ylidene]methyl]phenyl 3,5-dinitrobenzoate

IUPAC name

4-[(E)-[2-(24-dinitrophenyl)hydrazin-1-ylidene]methyl]phenyl 35-dinitrobenzoate

SMILES

[O-][N+](c(cc1)cc([N+]([O-])=O)c1N/N=C/c(cc1)ccc1OC(c1cc([N+]([O-])=O)cc([N+]([O-])=O)c1)=O)=O

InChI

InChI=1S/C20H12N6O10/c27-20(13-7-15(24(30)31)9-16(8-13)25(32)33)36-17-4-1-12(2-5-17)11-21-22-18-6-3-14(23(28)29)10-19(18)26(34)35/h1-11,22H

InChI Key

ODGPBJBDXUFIBW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01240059

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.35

Hydrogen Bond Acceptors Count

20.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

16

Partition Coefficient, logP

4.434

Distribution Coefficient, logD

4.431

Water Solubility, LogSw

-4.55

Polar Surface Area

174.281

Acid Dissociation Constant (pKa)

9.62

Base Dissociation Constant (pKb)

1.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8008-1467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-1467?
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What is the minimum amount of 8008-1467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-1467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-1467
  • 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 8008-1467 available by request