5695-4571 Screening compound: N'-[(E)-(1H-indol-3-yl)methylidene]-2-(naphthalen-1-yl)acetohydrazide

5695-4571 Screening compound: N'-[(E)-(1H-indol-3-yl)methylidene]-2-(naphthalen-1-yl)acetohydrazide
5695-4571 Screening compound: N'-[(E)-(1H-indol-3-yl)methylidene]-2-(naphthalen-1-yl)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5695-4571
N'-[(E)-(1H-indol-3-yl)methylidene]-2-(naphthalen-1-yl)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

5695-4571

Molecular Formula

C21H17N3O (C21 H17 N3 O)

Compound Name

N'-[(E)-(1H-indol-3-yl)methylidene]-2-(naphthalen-1-yl)acetohydrazide

IUPAC name

N'-[(E)-(1H-indol-3-yl)methylidene]-2-(naphthalen-1-yl)acetohydrazide

SMILES

O=C(Cc1cccc2ccccc12)N/N=C/c1c[nH]c2c1cccc2

InChI

InChI=1S/C21H17N3O/c25-21(12-16-8-5-7-15-6-1-2-9-18(15)16)24-23-14-17-13-22-20-11-4-3-10-19(17)20/h1-11,13-14,22H,12H2,(H,24,25)

InChI Key

AMNYPOYHYBTCMY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00737497

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.544

Distribution Coefficient, logD

4.543

Water Solubility, LogSw

-4.73

Polar Surface Area

44.940

Acid Dissociation Constant (pKa)

10.07

Base Dissociation Constant (pKb)

1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

5695-4571 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 5695-4571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5695-4571?
Check Price and Availability of 5695-4571, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 5695-4571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5695-4571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5695-4571
  • 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 5695-4571 available by request