8002-6253 Screening compound: 2-(4-bromonaphthalen-1-yl)-N'-[(1E)-1-(1,2-dihydroacenaphthylen-5-yl)ethylidene]acetohydrazide

8002-6253 Screening compound: 2-(4-bromonaphthalen-1-yl)-N'-[(1E)-1-(1,2-dihydroacenaphthylen-5-yl)ethylidene]acetohydrazide
8002-6253 Screening compound: 2-(4-bromonaphthalen-1-yl)-N'-[(1E)-1-(1,2-dihydroacenaphthylen-5-yl)ethylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-6253
2-(4-bromonaphthalen-1-yl)-N'-[(1E)-1-(1,2-dihydroacenaphthylen-5-yl)ethylidene]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

8002-6253

Molecular Formula

C26H21BrN2O (C26 H21 BrN2 O)

Compound Name

2-(4-bromonaphthalen-1-yl)-N'-[(1E)-1-(1,2-dihydroacenaphthylen-5-yl)ethylidene]acetohydrazide

IUPAC name

2-(4-bromonaphthalen-1-yl)-N'-[(1E)-1-(12-dihydroacenaphthylen-5-yl)ethylidene]acetohydrazide

SMILES

C/C(/c1ccc(CC2)c3c2cccc13)=N\NC(Cc(c1ccccc11)ccc1Br)=O

InChI

InChI=1S/C26H21BrN2O/c1-16(20-13-11-18-10-9-17-5-4-8-23(20)26(17)18)28-29-25(30)15-19-12-14-24(27)22-7-3-2-6-21(19)22/h2-8,11-14H,9-10,15H2,1H3,(H,29,30)

InChI Key

SOCHAHOFAGRJOW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00733018

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.226

Distribution Coefficient, logD

7.225

Water Solubility, LogSw

-6.25

Polar Surface Area

34.372

Acid Dissociation Constant (pKa)

9.89

Base Dissociation Constant (pKb)

4.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

8002-6253 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8002-6253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-6253?
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What is the minimum amount of 8002-6253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-6253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-6253
  • 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 8002-6253 available by request