4072-3234 Screening compound: 2-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1H-isoindole-1,3-dione

4072-3234 Screening compound: 2-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1H-isoindole-1,3-dione
4072-3234 Screening compound: 2-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1H-isoindole-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4072-3234
2-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1H-isoindole-1,3-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

4072-3234

Molecular Formula

C16H18N2O3 (C16 H18 N2 O3)

Compound Name

2-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1H-isoindole-1,3-dione

IUPAC name

2-[3-oxo-3-(piperidin-1-yl)propyl]-23-dihydro-1H-isoindole-13-dione

SMILES

O=C(CCN(C(c1c2cccc1)=O)C2=O)N1CCCCC1

InChI

InChI=1S/C16H18N2O3/c19-14(17-9-4-1-5-10-17)8-11-18-15(20)12-6-2-3-7-13(12)16(18)21/h2-3,6-7H,1,4-5,8-11H2

InChI Key

PZEXMHGVMUYUBB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00266418

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.412

Distribution Coefficient, logD

1.412

Water Solubility, LogSw

-1.96

Polar Surface Area

45.862

Acid Dissociation Constant (pKa)

23.79

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

4072-3234 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
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 4072-3234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4072-3234?
Check Price and Availability of 4072-3234, 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 4072-3234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4072-3234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4072-3234
  • 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 4072-3234 available by request