P658-0936 Screening compound: N-butyl-4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methylfuran-2-sulfonamide

P658-0936 Screening compound: N-butyl-4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methylfuran-2-sulfonamide
P658-0936 Screening compound: N-butyl-4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methylfuran-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P658-0936
N-butyl-4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methylfuran-2-sulfonamide

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

P658-0936

Molecular Formula

C16H23N3O4S (C16 H23 N3 O4 S)

Compound Name

N-butyl-4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methylfuran-2-sulfonamide

IUPAC name

N-butyl-4-(5-cyclopentyl-134-oxadiazol-2-yl)-N-methylfuran-2-sulfonamide

SMILES

CCCCN(C)S(c1cc(-c2nnc(C3CCCC3)o2)co1)(=O)=O

InChI

InChI=1S/C16H23N3O4S/c1-3-4-9-19(2)24(20,21)14-10-13(11-22-14)16-18-17-15(23-16)12-7-5-6-8-12/h10-12H,3-9H2,1-2H3

InChI Key

HQKZUSYPKIVHAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27609764

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.44

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.522

Distribution Coefficient, logD

3.522

Water Solubility, LogSw

-3.66

Polar Surface Area

74.013

Acid Dissociation Constant (pKa)

26.07

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

P658-0936 in Drug Discovery

Included in Screening Libraries

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

CNS MPO Library (28609 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with P658-0936 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P658-0936?
Check Price and Availability of P658-0936, 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 P658-0936 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P658-0936
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P658-0936
  • 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 P658-0936 available by request