P435-0227 Screening compound: 2-CYCLOPENTYL-1-{4-[5-METHYL-4-(1-PYRROLIDINYLCARBONYL)-1,3-OXAZOL-2-YL]PIPERIDINO}-1-ETHANONE

P435-0227 Screening compound: 2-CYCLOPENTYL-1-{4-[5-METHYL-4-(1-PYRROLIDINYLCARBONYL)-1,3-OXAZOL-2-YL]PIPERIDINO}-1-ETHANONE
P435-0227 Screening compound: 2-CYCLOPENTYL-1-{4-[5-METHYL-4-(1-PYRROLIDINYLCARBONYL)-1,3-OXAZOL-2-YL]PIPERIDINO}-1-ETHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound P435-0227
2-CYCLOPENTYL-1-{4-[5-METHYL-4-(1-PYRROLIDINYLCARBONYL)-1,3-OXAZOL-2-YL]PIPERIDINO}-1-ETHANONE

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

P435-0227

Molecular Formula

C21H31N3O3 (C21 H31 N3 O3)

Compound Name

2-CYCLOPENTYL-1-{4-[5-METHYL-4-(1-PYRROLIDINYLCARBONYL)-1,3-OXAZOL-2-YL]PIPERIDINO}-1-ETHANONE

IUPAC name

n/a

SMILES

Cc1c(C(N2CCCC2)=O)nc(C(CC2)CCN2C(CC2CCCC2)=O)o1

InChI

InChI=1S/C21H31N3O3/c1-15-19(21(26)24-10-4-5-11-24)22-20(27-15)17-8-12-23(13-9-17)18(25)14-16-6-2-3-7-16/h16-17H,2-14H2,1H3

InChI Key

WYRZYAGJQUYFGD-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.861

Distribution Coefficient, logD

2.861

Water Solubility, LogSw

-2.69

Polar Surface Area

51.559

Acid Dissociation Constant (pKa)

24.23

Base Dissociation Constant (pKb)

-0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

76.20

P435-0227 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P435-0227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P435-0227?
Check Price and Availability of P435-0227, 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 P435-0227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P435-0227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P435-0227
  • 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 P435-0227 available by request