5940-0056 Screening compound: N-benzyl-N-[2-(benzylamino)-4-quinazolinyl]amine

5940-0056 Screening compound: N-benzyl-N-[2-(benzylamino)-4-quinazolinyl]amine
5940-0056 Screening compound: N-benzyl-N-[2-(benzylamino)-4-quinazolinyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5940-0056
N-benzyl-N-[2-(benzylamino)-4-quinazolinyl]amine

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

5940-0056

Molecular Formula

C22H20N4 (C22 H20 N4)

Compound Name

N-benzyl-N-[2-(benzylamino)-4-quinazolinyl]amine

IUPAC name

N2N4-dibenzylquinazoline-24-diamine

SMILES

C(c1ccccc1)Nc1nc(NCc2ccccc2)nc2ccccc12

InChI

InChI=1S/C22H20N4/c1-3-9-17(10-4-1)15-23-21-19-13-7-8-14-20(19)25-22(26-21)24-16-18-11-5-2-6-12-18/h1-14H,15-16H2,(H2,23,24,25,26)

InChI Key

QAIMUUJJAJBPCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03691820

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.43

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.856

Distribution Coefficient, logD

4.064

Water Solubility, LogSw

-5.09

Polar Surface Area

40.768

Acid Dissociation Constant (pKa)

16.83

Base Dissociation Constant (pKb)

8.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.09

5940-0056 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS targets activity set (6557 compounds)

Hsp90-Targeted Library (11355 compounds)

SmartTM Library (51161 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 5940-0056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5940-0056?
Check Price and Availability of 5940-0056, 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 5940-0056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5940-0056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5940-0056
  • 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 5940-0056 available by request