0764-0642 Screening compound: 1-(2-bromoethyl)-2,3-dihydro-1H-indole-2,3-dione

0764-0642 Screening compound: 1-(2-bromoethyl)-2,3-dihydro-1H-indole-2,3-dione
0764-0642 Screening compound: 1-(2-bromoethyl)-2,3-dihydro-1H-indole-2,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0764-0642
1-(2-bromoethyl)-2,3-dihydro-1H-indole-2,3-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

0764-0642

Molecular Formula

C10H8BrNO2 (C10 H8 BrNO2)

Compound Name

1-(2-bromoethyl)-2,3-dihydro-1H-indole-2,3-dione

IUPAC name

1-(2-bromoethyl)-23-dihydro-1H-indole-23-dione

SMILES

O=C(c(cccc1)c1N1CCBr)C1=O

InChI

InChI=1S/C10H8BrNO2/c11-5-6-12-8-4-2-1-3-7(8)9(13)10(12)14/h1-4H,5-6H2

InChI Key

SJALPCXFOSGNST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00224227

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

254.08

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.714

Distribution Coefficient, logD

1.714

Water Solubility, LogSw

-2.45

Polar Surface Area

29.103

Acid Dissociation Constant (pKa)

26.32

Base Dissociation Constant (pKb)

-2.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

0764-0642 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro
Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0764-0642 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0764-0642?
Check Price and Availability of 0764-0642, 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 0764-0642 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0764-0642
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0764-0642
  • 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 0764-0642 available by request