P859-1244 Screening compound: {2,5-DIMETHYL-1-[1-(METHYLSULFONYL)-4-PIPERIDYL]-1H-IMIDAZOL-4-YL}(PIPERIDINO)METHANONE

P859-1244 Screening compound: {2,5-DIMETHYL-1-[1-(METHYLSULFONYL)-4-PIPERIDYL]-1H-IMIDAZOL-4-YL}(PIPERIDINO)METHANONE
P859-1244 Screening compound: {2,5-DIMETHYL-1-[1-(METHYLSULFONYL)-4-PIPERIDYL]-1H-IMIDAZOL-4-YL}(PIPERIDINO)METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound P859-1244
{2,5-DIMETHYL-1-[1-(METHYLSULFONYL)-4-PIPERIDYL]-1H-IMIDAZOL-4-YL}(PIPERIDINO)METHANONE

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

P859-1244

Molecular Formula

C17H28N4O3S (C17 H28 N4 O3 S)

Compound Name

{2,5-DIMETHYL-1-[1-(METHYLSULFONYL)-4-PIPERIDYL]-1H-IMIDAZOL-4-YL}(PIPERIDINO)METHANONE

IUPAC name

4-[25-dimethyl-4-(piperidine-1-carbonyl)-1H-imidazol-1-yl]-1-methanesulfonylpiperidine

SMILES

Cc1c(C(N2CCCCC2)=O)nc(C)n1C(CC1)CCN1S(C)(=O)=O

InChI

InChI=1S/C17H28N4O3S/c1-13-16(17(22)19-9-5-4-6-10-19)18-14(2)21(13)15-7-11-20(12-8-15)25(3,23)24/h15H,4-12H2,1-3H3

InChI Key

WCCLFMFZZJEYCX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29026043

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.143

Distribution Coefficient, logD

1.142

Water Solubility, LogSw

-1.73

Polar Surface Area

60.732

Acid Dissociation Constant (pKa)

22.83

Base Dissociation Constant (pKb)

4.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

76.47

P859-1244 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Bromodomain Modulators Library (5801 compounds)

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 P859-1244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P859-1244?
Check Price and Availability of P859-1244, 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 P859-1244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P859-1244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P859-1244
  • 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 P859-1244 available by request