3494-0030 Screening compound: 4-[(E)-[(4-acetamidophenyl)imino]methyl]-3-hydroxy-N-phenylnaphthalene-2-carboxamide

3494-0030 Screening compound: 4-[(E)-[(4-acetamidophenyl)imino]methyl]-3-hydroxy-N-phenylnaphthalene-2-carboxamide
3494-0030 Screening compound: 4-[(E)-[(4-acetamidophenyl)imino]methyl]-3-hydroxy-N-phenylnaphthalene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3494-0030
4-[(E)-[(4-acetamidophenyl)imino]methyl]-3-hydroxy-N-phenylnaphthalene-2-carboxamide

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

3494-0030

Molecular Formula

C26H21N3O3 (C26 H21 N3 O3)

Compound Name

4-[(E)-[(4-acetamidophenyl)imino]methyl]-3-hydroxy-N-phenylnaphthalene-2-carboxamide

IUPAC name

4-[(E)-[(4-acetamidophenyl)imino]methyl]-3-hydroxy-N-phenylnaphthalene-2-carboxamide

SMILES

CC(Nc(cc1)ccc1/N=C/c(c1ccccc1cc1C(Nc2ccccc2)=O)c1O)=O

InChI

InChI=1S/C26H21N3O3/c1-17(30)28-21-13-11-19(12-14-21)27-16-24-22-10-6-5-7-18(22)15-23(25(24)31)26(32)29-20-8-3-2-4-9-20/h2-16,31H,1H3,(H,28,30)(H,29,32)

InChI Key

MUWJDZHXKYTBCX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00514260

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.801

Distribution Coefficient, logD

3.957

Water Solubility, LogSw

-5.26

Polar Surface Area

69.927

Acid Dissociation Constant (pKa)

6.62

Base Dissociation Constant (pKb)

4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.80

3494-0030 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 3494-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3494-0030?
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What is the minimum amount of 3494-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3494-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3494-0030
  • 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 3494-0030 available by request