K784-1422 Screening compound: N-(4-ethoxyphenyl)-4-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3-nitrobenzamide

K784-1422 Screening compound: N-(4-ethoxyphenyl)-4-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3-nitrobenzamide
K784-1422 Screening compound: N-(4-ethoxyphenyl)-4-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-1422
N-(4-ethoxyphenyl)-4-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3-nitrobenzamide

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

K784-1422

Molecular Formula

C27H32N4O4 (C27 H32 N4 O4)

Compound Name

N-(4-ethoxyphenyl)-4-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3-nitrobenzamide

IUPAC name

N-(4-ethoxyphenyl)-4-({3-[ethyl(3-methylphenyl)amino]propyl}amino)-3-nitrobenzamide

SMILES

CCN(CCCNc(ccc(C(Nc(cc1)ccc1OCC)=O)c1)c1[N+]([O-])=O)c1cc(C)ccc1

InChI

InChI=1S/C27H32N4O4/c1-4-30(23-9-6-8-20(3)18-23)17-7-16-28-25-15-10-21(19-26(25)31(33)34)27(32)29-22-11-13-24(14-12-22)35-5-2/h6,8-15,18-19,28H,4-5,7,16-17H2,1-3H3,(H,29,32)

InChI Key

VNHKQLZURUJYBE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03019619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.020

Distribution Coefficient, logD

6.013

Water Solubility, LogSw

-5.39

Polar Surface Area

75.902

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

5.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

K784-1422 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 K784-1422 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-1422?
Check Price and Availability of K784-1422, 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 K784-1422 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-1422
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-1422
  • 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 K784-1422 available by request