3433-1998 Screening compound: N'-[(E)-(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazide

3433-1998 Screening compound: N'-[(E)-(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazide
3433-1998 Screening compound: N'-[(E)-(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3433-1998
N'-[(E)-(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]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

3433-1998

Molecular Formula

C25H33ClN2O4 (C25 H33 ClN2 O4)

Compound Name

N'-[(E)-(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetohydrazide

IUPAC name

N'-[(E)-(3-chloro-5-ethoxy-4-hydroxyphenyl)methylidene]-2-[4-(244-trimethylpentan-2-yl)phenoxy]acetohydrazide

SMILES

CCOc1cc(/C=N/NC(COc2ccc(C(C)(C)CC(C)(C)C)cc2)=O)cc(Cl)c1O

InChI

InChI=1S/C25H33ClN2O4/c1-7-31-21-13-17(12-20(26)23(21)30)14-27-28-22(29)15-32-19-10-8-18(9-11-19)25(5,6)16-24(2,3)4/h8-14,30H,7,15-16H2,1-6H3,(H,28,29)

InChI Key

PGDZLMCCODXDAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00739698

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.087

Distribution Coefficient, logD

7.062

Water Solubility, LogSw

-5.94

Polar Surface Area

65.529

Acid Dissociation Constant (pKa)

8.64

Base Dissociation Constant (pKb)

2.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

3433-1998 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

New Agro Library (44492 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Agro:
  • Agro
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3433-1998 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3433-1998?
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What is the minimum amount of 3433-1998 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3433-1998
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3433-1998
  • 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 3433-1998 available by request