8004-1261 Screening compound: 2-(2,4-dichlorophenoxy)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]acetohydrazide

8004-1261 Screening compound: 2-(2,4-dichlorophenoxy)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]acetohydrazide
8004-1261 Screening compound: 2-(2,4-dichlorophenoxy)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-1261
2-(2,4-dichlorophenoxy)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)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

8004-1261

Molecular Formula

C17H16Cl2N2O5 (C17 H16 Cl2 N2 O5)

Compound Name

2-(2,4-dichlorophenoxy)-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]acetohydrazide

IUPAC name

2-(24-dichlorophenoxy)-N'-[(E)-(4-hydroxy-35-dimethoxyphenyl)methylidene]acetohydrazide

SMILES

COc1cc(/C=N/NC(COc(ccc(Cl)c2)c2Cl)=O)cc(OC)c1O

InChI

InChI=1S/C17H16Cl2N2O5/c1-24-14-5-10(6-15(25-2)17(14)23)8-20-21-16(22)9-26-13-4-3-11(18)7-12(13)19/h3-8,23H,9H2,1-2H3,(H,21,22)

InChI Key

OJXKTAMLVHDIRB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00363988

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.23

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.987

Distribution Coefficient, logD

2.981

Water Solubility, LogSw

-3.27

Polar Surface Area

73.667

Acid Dissociation Constant (pKa)

9.24

Base Dissociation Constant (pKb)

3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

8004-1261 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 8004-1261 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-1261?
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What is the minimum amount of 8004-1261 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-1261
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-1261
  • 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 8004-1261 available by request