S693-1528 Screening compound: 3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-N-(2-ethoxyphenyl)piperidine-1-carboxamide

S693-1528 Screening compound: 3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-N-(2-ethoxyphenyl)piperidine-1-carboxamide
S693-1528 Screening compound: 3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-N-(2-ethoxyphenyl)piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S693-1528
3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-N-(2-ethoxyphenyl)piperidine-1-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

S693-1528

Molecular Formula

C20H28N4O2 (C20 H28 N4 O2)

Compound Name

3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]-N-(2-ethoxyphenyl)piperidine-1-carboxamide

IUPAC name

3-[(25-dimethyl-1H-imidazol-1-yl)methyl]-N-(2-ethoxyphenyl)piperidine-1-carboxamide

SMILES

CCOc(cccc1)c1NC(N1CC(Cn2c(C)ncc2C)CCC1)=O

InChI

InChI=1S/C20H28N4O2/c1-4-26-19-10-6-5-9-18(19)22-20(25)23-11-7-8-17(13-23)14-24-15(2)12-21-16(24)3/h5-6,9-10,12,17H,4,7-8,11,13-14H2,1-3H3,(H,22,25)/t17-/m0/s1

InChI Key

GNLJZXIUVXEPAI-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD31976730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.303

Distribution Coefficient, logD

1.964

Water Solubility, LogSw

-3.28

Polar Surface Area

44.115

Acid Dissociation Constant (pKa)

12.60

Base Dissociation Constant (pKb)

8.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

S693-1528 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 S693-1528 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S693-1528?
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What is the minimum amount of S693-1528 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S693-1528
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S693-1528
  • 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 S693-1528 available by request