8011-2789 Screening compound: 6-chloro-3H-dibenzo[de,h]cinnoline-3,7(2H)-dione

8011-2789 Screening compound: 6-chloro-3H-dibenzo[de,h]cinnoline-3,7(2H)-dione
8011-2789 Screening compound: 6-chloro-3H-dibenzo[de,h]cinnoline-3,7(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-2789
6-chloro-3H-dibenzo[de,h]cinnoline-3,7(2H)-dione

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

8011-2789

Molecular Formula

C15H7ClN2O2 (C15 H7 ClN2 O2)

Compound Name

6-chloro-3H-dibenzo[de,h]cinnoline-3,7(2H)-dione

IUPAC name

10-chloro-1516-diazatetracyclo[7.7.1.0^{27}.0^{1317}]heptadeca-1(16)2(7)359(17)1012-heptaene-814-dione

SMILES

O=C(c(cccc1)c1C(c1c2cc3)=NNC2=O)c1c3Cl

InChI

InChI=1S/C15H7ClN2O2/c16-10-6-5-9-11-12(10)14(19)8-4-2-1-3-7(8)13(11)17-18-15(9)20/h1-6H,(H,18,20)

InChI Key

XLFSYPUCEGFFBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00980188

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.69

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.999

Distribution Coefficient, logD

2.349

Water Solubility, LogSw

-4.00

Polar Surface Area

48.918

Acid Dissociation Constant (pKa)

10.68

Base Dissociation Constant (pKb)

6.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8011-2789 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 8011-2789 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-2789?
Check Price and Availability of 8011-2789, 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 8011-2789 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-2789
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-2789
  • 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 8011-2789 available by request