5593-2360 Screening compound: 1'-{2,5-dioxo-1-[4-(trifluoromethyl)phenyl]pyrrolidin-3-yl}-[1,4'-bipiperidine]-4'-carboxamide

5593-2360 Screening compound: 1'-{2,5-dioxo-1-[4-(trifluoromethyl)phenyl]pyrrolidin-3-yl}-[1,4'-bipiperidine]-4'-carboxamide
5593-2360 Screening compound: 1'-{2,5-dioxo-1-[4-(trifluoromethyl)phenyl]pyrrolidin-3-yl}-[1,4'-bipiperidine]-4'-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5593-2360
1'-{2,5-dioxo-1-[4-(trifluoromethyl)phenyl]pyrrolidin-3-yl}-[1,4'-bipiperidine]-4'-carboxamide

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

5593-2360

Molecular Formula

C22H27F3N4O3 (C22 H27 F3 N4 O3)

Compound Name

1'-{2,5-dioxo-1-[4-(trifluoromethyl)phenyl]pyrrolidin-3-yl}-[1,4'-bipiperidine]-4'-carboxamide

IUPAC name

1'-{25-dioxo-1-[4-(trifluoromethyl)phenyl]pyrrolidin-3-yl}-[14'-bipiperidine]-4'-carboxamide

SMILES

NC(C(CC1)(CCN1C(CC(N1c2ccc(C(F)(F)F)cc2)=O)C1=O)N1CCCCC1)=O

InChI

InChI=1S/C22H27F3N4O3/c23-22(24,25)15-4-6-16(7-5-15)29-18(30)14-17(19(29)31)27-12-8-21(9-13-27,20(26)32)28-10-2-1-3-11-28/h4-7,17H,1-3,8-14H2,(H2,26,32)/t17-/m1/s1

InChI Key

LHRJMOPJYXLZPJ-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD03487324

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.816

Distribution Coefficient, logD

1.641

Water Solubility, LogSw

-2.20

Polar Surface Area

69.124

Acid Dissociation Constant (pKa)

14.52

Base Dissociation Constant (pKb)

7.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

59.09

5593-2360 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-HIV1 Library (19540 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5593-2360 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5593-2360?
Check Price and Availability of 5593-2360, 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 5593-2360 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5593-2360
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5593-2360
  • 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 5593-2360 available by request