8002-3616 Screening compound: 2-(2-bromo-4-chlorophenoxy)-N'-[(E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]acetohydrazide

8002-3616 Screening compound: 2-(2-bromo-4-chlorophenoxy)-N'-[(E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]acetohydrazide
8002-3616 Screening compound: 2-(2-bromo-4-chlorophenoxy)-N'-[(E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-3616
2-(2-bromo-4-chlorophenoxy)-N'-[(E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]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

8002-3616

Molecular Formula

C15H10Br3ClN2O4 (C15 H10 Br3 ClN2 O4)

Compound Name

2-(2-bromo-4-chlorophenoxy)-N'-[(E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]acetohydrazide

IUPAC name

2-(2-bromo-4-chlorophenoxy)-N'-[(E)-(35-dibromo-24-dihydroxyphenyl)methylidene]acetohydrazide

SMILES

Oc(c(Br)c1O)c(/C=N/NC(COc(ccc(Cl)c2)c2Br)=O)cc1Br

InChI

InChI=1S/C15H10Br3ClN2O4/c16-9-4-8(19)1-2-11(9)25-6-12(22)21-20-5-7-3-10(17)15(24)13(18)14(7)23/h1-5,23-24H,6H2,(H,21,22)

InChI Key

ACLLWIMYYDSCGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00373443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

557.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.437

Distribution Coefficient, logD

5.004

Water Solubility, LogSw

-5.66

Polar Surface Area

73.885

Acid Dissociation Constant (pKa)

7.17

Base Dissociation Constant (pKb)

3.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

8002-3616 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 8002-3616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-3616?
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What is the minimum amount of 8002-3616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-3616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-3616
  • 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 8002-3616 available by request