8018-3600 Screening compound: 1-(1-methyl-1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethane-1,2-dione

8018-3600 Screening compound: 1-(1-methyl-1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethane-1,2-dione
8018-3600 Screening compound: 1-(1-methyl-1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethane-1,2-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3600
1-(1-methyl-1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethane-1,2-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

8018-3600

Molecular Formula

C15H16N2O2 (C15 H16 N2 O2)

Compound Name

1-(1-methyl-1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethane-1,2-dione

IUPAC name

1-(1-methyl-1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethane-12-dione

SMILES

Cn1c(cccc2)c2c(C(C(N2CCCC2)=O)=O)c1

InChI

InChI=1S/C15H16N2O2/c1-16-10-12(11-6-2-3-7-13(11)16)14(18)15(19)17-8-4-5-9-17/h2-3,6-7,10H,4-5,8-9H2,1H3

InChI Key

XUOQXJAMWYWMIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06191540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.097

Distribution Coefficient, logD

2.097

Water Solubility, LogSw

-2.65

Polar Surface Area

33.551

Acid Dissociation Constant (pKa)

27.61

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8018-3600 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Soluble Diversity Library (15920 compounds)

Anti-HIV1 Library (19540 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • 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 8018-3600 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3600?
Check Price and Availability of 8018-3600, 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 8018-3600 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3600
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3600
  • 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 8018-3600 available by request