G696-5766 Screening compound: 3-[(E)-{[4-(diphenylmethyl)piperazin-1-yl][(3-methoxypropyl)amino]methylidene}amino]benzoic acid

G696-5766 Screening compound: 3-[(E)-{[4-(diphenylmethyl)piperazin-1-yl][(3-methoxypropyl)amino]methylidene}amino]benzoic acid
G696-5766 Screening compound: 3-[(E)-{[4-(diphenylmethyl)piperazin-1-yl][(3-methoxypropyl)amino]methylidene}amino]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound G696-5766
3-[(E)-{[4-(diphenylmethyl)piperazin-1-yl][(3-methoxypropyl)amino]methylidene}amino]benzoic acid

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

G696-5766

Molecular Formula

C29H34N4O3 (C29 H34 N4 O3)

Compound Name

3-[(E)-{[4-(diphenylmethyl)piperazin-1-yl][(3-methoxypropyl)amino]methylidene}amino]benzoic acid

IUPAC name

3-[(E)-{[4-(diphenylmethyl)piperazin-1-yl][(3-methoxypropyl)amino]methylidene}amino]benzoic acid

SMILES

COCCCN/C(/N(CC1)CCN1C(c1ccccc1)c1ccccc1)=N\c1cccc(C(O)=O)c1

InChI

InChI=1S/C29H34N4O3/c1-36-21-9-16-30-29(31-26-15-8-14-25(22-26)28(34)35)33-19-17-32(18-20-33)27(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-8,10-15,22,27H,9,16-21H2,1H3,(H,30,31)(H,34,35)

InChI Key

ICNDVUYJPRJNBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27151413

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

486.61

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.273

Distribution Coefficient, logD

5.273

Water Solubility, LogSw

-4.98

Polar Surface Area

60.711

Acid Dissociation Constant (pKa)

4.21

Base Dissociation Constant (pKb)

8.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.00

G696-5766 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G696-5766 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G696-5766?
Check Price and Availability of G696-5766, 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 G696-5766 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G696-5766
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G696-5766
  • 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 G696-5766 available by request