S214-1436 Screening compound: 1-cyclopentanecarbonyl-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol

S214-1436 Screening compound: 1-cyclopentanecarbonyl-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol
S214-1436 Screening compound: 1-cyclopentanecarbonyl-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound S214-1436
1-cyclopentanecarbonyl-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol

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

S214-1436

Molecular Formula

C21H30N2O2 (C21 H30 N2 O2)

Compound Name

1-cyclopentanecarbonyl-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol

IUPAC name

(3R4S)-1-cyclopentanecarbonyl-4-phenyl-3-(pyrrolidin-1-yl)piperidin-4-ol

SMILES

O[C@@](CCN(C1)C(C2CCCC2)=O)([C@H]1N1CCCC1)c1ccccc1

InChI

InChI=1S/C21H30N2O2/c24-20(17-8-4-5-9-17)23-15-12-21(25,18-10-2-1-3-11-18)19(16-23)22-13-6-7-14-22/h1-3,10-11,17,19,25H,4-9,12-16H2/t19-,21+/m0/s1

InChI Key

IZNBZSHHXFFZAO-PZJWPPBQSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.740

Distribution Coefficient, logD

2.051

Water Solubility, LogSw

-2.86

Polar Surface Area

35.031

Acid Dissociation Constant (pKa)

14.99

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

66.70

S214-1436 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D Mimetics PPI Library (1617 compounds)

CNS BBB Library (22607 compounds)

GPCR Targeted Library (31838 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Soluble Diversity Library (15920 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Epigenetics Focused Set (26518 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

New Agro Library (44492 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • 3D
  • Mimetics
  • Mimetics
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with S214-1436 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S214-1436?
Check Price and Availability of S214-1436, 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 S214-1436 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S214-1436
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S214-1436
  • 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 S214-1436 available by request