C743-0024 Screening compound: 1-phenyl-2-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepin-4-yl)-1,2-ethanedione

C743-0024 Screening compound: 1-phenyl-2-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepin-4-yl)-1,2-ethanedione
C743-0024 Screening compound: 1-phenyl-2-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepin-4-yl)-1,2-ethanedione alternative view

Chemical Structure Depiction of ChemDiv screening compound C743-0024
1-phenyl-2-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepin-4-yl)-1,2-ethanedione

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

C743-0024

Molecular Formula

C17H16N2O2 (C17 H16 N2 O2)

Compound Name

1-phenyl-2-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepin-4-yl)-1,2-ethanedione

IUPAC name

1-phenyl-2-(2345-tetrahydro-1H-14-benzodiazepin-4-yl)ethane-12-dione

SMILES

O=C(C(N1Cc(cccc2)c2NCC1)=O)c1ccccc1

InChI

InChI=1S/C17H16N2O2/c20-16(13-6-2-1-3-7-13)17(21)19-11-10-18-15-9-5-4-8-14(15)12-19/h1-9,18H,10-12H2

InChI Key

LGAAECCJIZBMOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26965881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.419

Distribution Coefficient, logD

2.419

Water Solubility, LogSw

-2.78

Polar Surface Area

42.177

Acid Dissociation Constant (pKa)

22.03

Base Dissociation Constant (pKb)

3.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.65

C743-0024 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiviral Library (67538 compounds)

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

Fragments Library (11262 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases
Structure:
  • Fragments
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with C743-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C743-0024?
Check Price and Availability of C743-0024, 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 C743-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C743-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C743-0024
  • 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 C743-0024 available by request