F998-5045 Screening compound: 1-[1-(4-ethoxybenzoyl)-4-piperidyl]-3-ethyltetrahydro-2H-imidazol-2-one

F998-5045 Screening compound: 1-[1-(4-ethoxybenzoyl)-4-piperidyl]-3-ethyltetrahydro-2H-imidazol-2-one
F998-5045 Screening compound: 1-[1-(4-ethoxybenzoyl)-4-piperidyl]-3-ethyltetrahydro-2H-imidazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F998-5045
1-[1-(4-ethoxybenzoyl)-4-piperidyl]-3-ethyltetrahydro-2H-imidazol-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

F998-5045

Molecular Formula

C19H27N3O3 (C19 H27 N3 O3)

Compound Name

1-[1-(4-ethoxybenzoyl)-4-piperidyl]-3-ethyltetrahydro-2H-imidazol-2-one

IUPAC name

1-[1-(4-ethoxybenzoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one

SMILES

CCN(CCN1C(CC2)CCN2C(c(cc2)ccc2OCC)=O)C1=O

InChI

InChI=1S/C19H27N3O3/c1-3-20-13-14-22(19(20)24)16-9-11-21(12-10-16)18(23)15-5-7-17(8-6-15)25-4-2/h5-8,16H,3-4,9-14H2,1-2H3

InChI Key

PDQQNJKKWKBPSB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27208699

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.309

Distribution Coefficient, logD

2.309

Water Solubility, LogSw

-2.36

Polar Surface Area

43.572

Acid Dissociation Constant (pKa)

27.87

Base Dissociation Constant (pKb)

4.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

F998-5045 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F998-5045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F998-5045?
Check Price and Availability of F998-5045, 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 F998-5045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F998-5045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F998-5045
  • 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 F998-5045 available by request