1326-1662 Screening compound: 2-hydroxy-1H-benzo[de]isoquinoline-1,3(2H)-dione

1326-1662 Screening compound: 2-hydroxy-1H-benzo[de]isoquinoline-1,3(2H)-dione
1326-1662 Screening compound: 2-hydroxy-1H-benzo[de]isoquinoline-1,3(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1326-1662
2-hydroxy-1H-benzo[de]isoquinoline-1,3(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

1326-1662

Molecular Formula

C12H7NO3 (C12 H7 NO3)

Compound Name

2-hydroxy-1H-benzo[de]isoquinoline-1,3(2H)-dione

IUPAC name

3-hydroxy-3-azatricyclo[7.3.1.0^{513}]trideca-1(12)579(13)10-pentaene-24-dione

SMILES

ON(C(c1c2c3cccc2ccc1)=O)C3=O

InChI

InChI=1S/C12H7NO3/c14-11-8-5-1-3-7-4-2-6-9(10(7)8)12(15)13(11)16/h1-6,16H

InChI Key

KTWCUGUUDHJVIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00065062

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

213.19

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

1.086

Distribution Coefficient, logD

-1.938

Water Solubility, LogSw

-2.32

Polar Surface Area

46.287

Acid Dissociation Constant (pKa)

4.38

Base Dissociation Constant (pKb)

-9.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1326-1662 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 1326-1662 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1326-1662?
Check Price and Availability of 1326-1662, 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 1326-1662 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1326-1662
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1326-1662
  • 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 1326-1662 available by request