K784-1438 Screening compound: 4-({3-[benzyl(methyl)amino]propyl}amino)-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide

K784-1438 Screening compound: 4-({3-[benzyl(methyl)amino]propyl}amino)-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide
K784-1438 Screening compound: 4-({3-[benzyl(methyl)amino]propyl}amino)-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-1438
4-({3-[benzyl(methyl)amino]propyl}amino)-N-(3-fluoro-4-methylphenyl)-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

K784-1438

Molecular Formula

C25H27FN4O3 (C25 H27 FN4 O3)

Compound Name

4-({3-[benzyl(methyl)amino]propyl}amino)-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide

IUPAC name

4-({3-[benzyl(methyl)amino]propyl}amino)-N-(3-fluoro-4-methylphenyl)-3-nitrobenzamide

SMILES

Cc(ccc(NC(c(cc1)cc([N+]([O-])=O)c1NCCCN(C)Cc1ccccc1)=O)c1)c1F

InChI

InChI=1S/C25H27FN4O3/c1-18-9-11-21(16-22(18)26)28-25(31)20-10-12-23(24(15-20)30(32)33)27-13-6-14-29(2)17-19-7-4-3-5-8-19/h3-5,7-12,15-16,27H,6,13-14,17H2,1-2H3,(H,28,31)

InChI Key

PMLUUOSHEJYGSN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03019630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.043

Distribution Coefficient, logD

4.185

Water Solubility, LogSw

-4.71

Polar Surface Area

69.883

Acid Dissociation Constant (pKa)

7.87

Base Dissociation Constant (pKb)

8.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

K784-1438 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with K784-1438 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-1438?
Check Price and Availability of K784-1438, 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 K784-1438 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-1438
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-1438
  • 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 K784-1438 available by request