S291-0019 Screening compound: 1-[3-(4-fluorophenoxy)propyl]pyrrolidin-2-one

S291-0019 Screening compound: 1-[3-(4-fluorophenoxy)propyl]pyrrolidin-2-one
S291-0019 Screening compound: 1-[3-(4-fluorophenoxy)propyl]pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S291-0019
1-[3-(4-fluorophenoxy)propyl]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

S291-0019

Molecular Formula

C13H16FNO2 (C13 H16 FNO2)

Compound Name

1-[3-(4-fluorophenoxy)propyl]pyrrolidin-2-one

IUPAC name

1-[3-(4-fluorophenoxy)propyl]pyrrolidin-2-one

SMILES

O=C1N(CCCOc(cc2)ccc2F)CCC1

InChI

InChI=1S/C13H16FNO2/c14-11-4-6-12(7-5-11)17-10-2-9-15-8-1-3-13(15)16/h4-7H,1-3,8-10H2

InChI Key

MIEIFISMYWDGGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19354743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

237.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.774

Distribution Coefficient, logD

1.774

Water Solubility, LogSw

-1.91

Polar Surface Area

24.897

Acid Dissociation Constant (pKa)

16.88

Base Dissociation Constant (pKb)

-2.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.15

S291-0019 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with S291-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S291-0019?
Check Price and Availability of S291-0019, 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 S291-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S291-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S291-0019
  • 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 S291-0019 available by request