CM4741-0133 Screening compound: 3-[(1-CYCLOHEXYL-4-PIPERIDYL)OXY]-1-CYCLOPENTYL-2-PYRROLIDINONE

CM4741-0133 Screening compound: 3-[(1-CYCLOHEXYL-4-PIPERIDYL)OXY]-1-CYCLOPENTYL-2-PYRROLIDINONE
CM4741-0133 Screening compound: 3-[(1-CYCLOHEXYL-4-PIPERIDYL)OXY]-1-CYCLOPENTYL-2-PYRROLIDINONE alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4741-0133
3-[(1-CYCLOHEXYL-4-PIPERIDYL)OXY]-1-CYCLOPENTYL-2-PYRROLIDINONE

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

CM4741-0133

Molecular Formula

C20H34N2O2 (C20 H34 N2 O2)

Compound Name

3-[(1-CYCLOHEXYL-4-PIPERIDYL)OXY]-1-CYCLOPENTYL-2-PYRROLIDINONE

IUPAC name

3-[(1-cyclohexylpiperidin-4-yl)oxy]-1-cyclopentylpyrrolidin-2-one

SMILES

O=C(C(CC1)OC(CC2)CCN2C2CCCCC2)N1C1CCCC1

InChI

InChI=1S/C20H34N2O2/c23-20-19(12-15-22(20)17-8-4-5-9-17)24-18-10-13-21(14-11-18)16-6-2-1-3-7-16/h16-19H,1-15H2/t19-/m0/s1

InChI Key

HUPYYGCNQVDEHI-IBGZPJMESA-N

MDL Number (MFCD)

MFCD30459038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.966

Distribution Coefficient, logD

0.766

Water Solubility, LogSw

-2.89

Polar Surface Area

25.980

Acid Dissociation Constant (pKa)

14.73

Base Dissociation Constant (pKb)

9.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

95.00

CM4741-0133 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with CM4741-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4741-0133?
Check Price and Availability of CM4741-0133, 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 CM4741-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4741-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4741-0133
  • 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 CM4741-0133 available by request