P658-0869 Screening compound: 4-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2-furyl]sulfonyl}morpholine

P658-0869 Screening compound: 4-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2-furyl]sulfonyl}morpholine
P658-0869 Screening compound: 4-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2-furyl]sulfonyl}morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound P658-0869
4-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2-furyl]sulfonyl}morpholine

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

P658-0869

Molecular Formula

C14H17N3O5S (C14 H17 N3 O5 S)

Compound Name

4-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2-furyl]sulfonyl}morpholine

IUPAC name

4-{[4-(5-cyclobutyl-134-oxadiazol-2-yl)furan-2-yl]sulfonyl}morpholine

SMILES

O=S(c1cc(-c2nnc(C3CCC3)o2)co1)(N1CCOCC1)=O

InChI

InChI=1S/C14H17N3O5S/c18-23(19,17-4-6-20-7-5-17)12-8-11(9-21-12)14-16-15-13(22-14)10-2-1-3-10/h8-10H,1-7H2

InChI Key

HGRPVBNRCNBVPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27609752

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.37

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.004

Distribution Coefficient, logD

1.004

Water Solubility, LogSw

-1.82

Polar Surface Area

80.783

Acid Dissociation Constant (pKa)

26.82

Base Dissociation Constant (pKb)

-1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.14

P658-0869 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P658-0869 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P658-0869?
Check Price and Availability of P658-0869, 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 P658-0869 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P658-0869
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P658-0869
  • 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 P658-0869 available by request