Y031-3606 Screening compound: 1-(4-ethoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one

Y031-3606 Screening compound: 1-(4-ethoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one
Y031-3606 Screening compound: 1-(4-ethoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-3606
1-(4-ethoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one

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

Y031-3606

Molecular Formula

C18H24N2O3 (C18 H24 N2 O3)

Compound Name

1-(4-ethoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one

IUPAC name

1-(4-ethoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidin-2-one

SMILES

CCOc(cc1)ccc1N(CC(C1)C(N2CCCCC2)=O)C1=O

InChI

InChI=1S/C18H24N2O3/c1-2-23-16-8-6-15(7-9-16)20-13-14(12-17(20)21)18(22)19-10-4-3-5-11-19/h6-9,14H,2-5,10-13H2,1H3/t14-/m1/s1

InChI Key

OUGIGHRHEXIVIA-CQSZACIVSA-N

MDL Number (MFCD)

MFCD07397919

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.175

Distribution Coefficient, logD

2.175

Water Solubility, LogSw

-2.50

Polar Surface Area

40.760

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.60

Y031-3606 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with Y031-3606 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-3606?
Check Price and Availability of Y031-3606, 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 Y031-3606 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-3606
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-3606
  • 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 Y031-3606 available by request