CM4368-1791 Screening compound: 1-(butylsulfonyl)-4-[2-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)ethyl]piperidine

CM4368-1791 Screening compound: 1-(butylsulfonyl)-4-[2-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)ethyl]piperidine
CM4368-1791 Screening compound: 1-(butylsulfonyl)-4-[2-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)ethyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4368-1791
1-(butylsulfonyl)-4-[2-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)ethyl]piperidine

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

CM4368-1791

Molecular Formula

C20H35N3O3S (C20 H35 N3 O3 S)

Compound Name

1-(butylsulfonyl)-4-[2-(5-methyl-2-tetrahydro-2H-pyran-4-yl-1H-imidazol-1-yl)ethyl]piperidine

IUPAC name

n/a

SMILES

CCCCS(N1CCC(CCn2c(C3CCOCC3)ncc2C)CC1)(=O)=O

InChI

InChI=1S/C20H35N3O3S/c1-3-4-15-27(24,25)22-10-5-18(6-11-22)7-12-23-17(2)16-21-20(23)19-8-13-26-14-9-19/h16,18-19H,3-15H2,1-2H3

InChI Key

XUBRMJIPGNRLJC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30465176

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.394

Distribution Coefficient, logD

2.163

Water Solubility, LogSw

-3.30

Polar Surface Area

51.107

Acid Dissociation Constant (pKa)

22.19

Base Dissociation Constant (pKb)

8.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

85.00

CM4368-1791 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with CM4368-1791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4368-1791?
Check Price and Availability of CM4368-1791, 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 CM4368-1791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4368-1791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4368-1791
  • 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 CM4368-1791 available by request