8008-6478 Screening compound: N'-[(E)-(3,5-dibromo-4-methoxyphenyl)methylidene]-4-(4-hydroxyphenoxy)benzohydrazide

8008-6478 Screening compound: N'-[(E)-(3,5-dibromo-4-methoxyphenyl)methylidene]-4-(4-hydroxyphenoxy)benzohydrazide
8008-6478 Screening compound: N'-[(E)-(3,5-dibromo-4-methoxyphenyl)methylidene]-4-(4-hydroxyphenoxy)benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-6478
N'-[(E)-(3,5-dibromo-4-methoxyphenyl)methylidene]-4-(4-hydroxyphenoxy)benzohydrazide

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

8008-6478

Molecular Formula

C21H16Br2N2O4 (C21 H16 Br2 N2 O4)

Compound Name

N'-[(E)-(3,5-dibromo-4-methoxyphenyl)methylidene]-4-(4-hydroxyphenoxy)benzohydrazide

IUPAC name

N'-[(E)-(35-dibromo-4-methoxyphenyl)methylidene]-4-(4-hydroxyphenoxy)benzohydrazide

SMILES

COc(c(Br)cc(/C=N/NC(c(cc1)ccc1Oc(cc1)ccc1O)=O)c1)c1Br

InChI

InChI=1S/C21H16Br2N2O4/c1-28-20-18(22)10-13(11-19(20)23)12-24-25-21(27)14-2-6-16(7-3-14)29-17-8-4-15(26)5-9-17/h2-12,26H,1H3,(H,25,27)

InChI Key

FKDGLMKPSNQSTP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01155267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.18

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.427

Distribution Coefficient, logD

5.187

Water Solubility, LogSw

-5.43

Polar Surface Area

67.636

Acid Dissociation Constant (pKa)

7.53

Base Dissociation Constant (pKb)

-0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

8008-6478 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8008-6478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-6478?
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What is the minimum amount of 8008-6478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-6478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-6478
  • 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 8008-6478 available by request