P657-0696 Screening compound: 2-cyclopropyl-5-[5-(pyrrolidine-1-sulfonyl)furan-2-yl]-1,3,4-oxadiazole

P657-0696 Screening compound: 2-cyclopropyl-5-[5-(pyrrolidine-1-sulfonyl)furan-2-yl]-1,3,4-oxadiazole
P657-0696 Screening compound: 2-cyclopropyl-5-[5-(pyrrolidine-1-sulfonyl)furan-2-yl]-1,3,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound P657-0696
2-cyclopropyl-5-[5-(pyrrolidine-1-sulfonyl)furan-2-yl]-1,3,4-oxadiazole

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

P657-0696

Molecular Formula

C13H15N3O4S (C13 H15 N3 O4 S)

Compound Name

2-cyclopropyl-5-[5-(pyrrolidine-1-sulfonyl)furan-2-yl]-1,3,4-oxadiazole

IUPAC name

2-cyclopropyl-5-[5-(pyrrolidine-1-sulfonyl)furan-2-yl]-134-oxadiazole

SMILES

O=S(c1ccc(-c2nnc(C3CC3)o2)o1)(N1CCCC1)=O

InChI

InChI=1S/C13H15N3O4S/c17-21(18,16-7-1-2-8-16)11-6-5-10(19-11)13-15-14-12(20-13)9-3-4-9/h5-6,9H,1-4,7-8H2

InChI Key

HQPCFHKINZGVDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27609472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.973

Distribution Coefficient, logD

1.973

Water Solubility, LogSw

-2.37

Polar Surface Area

71.974

Acid Dissociation Constant (pKa)

24.36

Base Dissociation Constant (pKb)

-0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

P657-0696 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 compounds)

GPCR Targeted Library (31838 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • GPCR
  • Others
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with P657-0696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P657-0696?
Check Price and Availability of P657-0696, 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 P657-0696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P657-0696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P657-0696
  • 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 P657-0696 available by request