S692-2052 Screening compound: 6-{3-[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]piperidine-1-carbonyl}-1H-indole

S692-2052 Screening compound: 6-{3-[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]piperidine-1-carbonyl}-1H-indole
S692-2052 Screening compound: 6-{3-[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]piperidine-1-carbonyl}-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound S692-2052
6-{3-[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]piperidine-1-carbonyl}-1H-indole

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

S692-2052

Molecular Formula

C20H24N4O2 (C20 H24 N4 O2)

Compound Name

6-{3-[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]piperidine-1-carbonyl}-1H-indole

IUPAC name

6-{3-[2-(methoxymethyl)-5-methyl-1H-imidazol-1-yl]piperidine-1-carbonyl}-1H-indole

SMILES

Cc1cnc(COC)n1C(CCC1)CN1C(c1cc([nH]cc2)c2cc1)=O

InChI

InChI=1S/C20H24N4O2/c1-14-11-22-19(13-26-2)24(14)17-4-3-9-23(12-17)20(25)16-6-5-15-7-8-21-18(15)10-16/h5-8,10-11,17,21H,3-4,9,12-13H2,1-2H3/t17-/m0/s1

InChI Key

BQMMRAUWEYAFGY-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD31966427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.709

Distribution Coefficient, logD

0.634

Water Solubility, LogSw

-2.28

Polar Surface Area

47.570

Acid Dissociation Constant (pKa)

17.71

Base Dissociation Constant (pKb)

8.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

S692-2052 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)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with S692-2052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S692-2052?
Check Price and Availability of S692-2052, 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 S692-2052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S692-2052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S692-2052
  • 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 S692-2052 available by request