3305-0509 Screening compound: 4-[(E)-[(4-chlorophenyl)imino]methyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide

3305-0509 Screening compound: 4-[(E)-[(4-chlorophenyl)imino]methyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide
3305-0509 Screening compound: 4-[(E)-[(4-chlorophenyl)imino]methyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3305-0509
4-[(E)-[(4-chlorophenyl)imino]methyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-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

3305-0509

Molecular Formula

C25H19ClN2O3 (C25 H19 ClN2 O3)

Compound Name

4-[(E)-[(4-chlorophenyl)imino]methyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide

IUPAC name

4-[(E)-[(4-chlorophenyl)imino]methyl]-3-hydroxy-N-(2-methoxyphenyl)naphthalene-2-carboxamide

SMILES

COc(cccc1)c1NC(c1cc2ccccc2c(/C=N/c(cc2)ccc2Cl)c1O)=O

InChI

InChI=1S/C25H19ClN2O3/c1-31-23-9-5-4-8-22(23)28-25(30)20-14-16-6-2-3-7-19(16)21(24(20)29)15-27-18-12-10-17(26)11-13-18/h2-15,29H,1H3,(H,28,30)

InChI Key

YINJOIJEGMKFCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00223263

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.89

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.338

Distribution Coefficient, logD

5.494

Water Solubility, LogSw

-6.10

Polar Surface Area

53.597

Acid Dissociation Constant (pKa)

6.62

Base Dissociation Constant (pKb)

3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

3305-0509 in Drug Discovery

Included in Screening Libraries

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 3305-0509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3305-0509?
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What is the minimum amount of 3305-0509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3305-0509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3305-0509
  • 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 3305-0509 available by request