SB48-0235 Screening compound: (1R,5S)-8-(methylsulfonyl)-3-{[1-(2-thienylmethyl)-4-piperidyl]oxy}-8-azabicyclo[3.2.1]octane

SB48-0235 Screening compound: (1R,5S)-8-(methylsulfonyl)-3-{[1-(2-thienylmethyl)-4-piperidyl]oxy}-8-azabicyclo[3.2.1]octane
SB48-0235 Screening compound: (1R,5S)-8-(methylsulfonyl)-3-{[1-(2-thienylmethyl)-4-piperidyl]oxy}-8-azabicyclo[3.2.1]octane alternative view

Chemical Structure Depiction of ChemDiv screening compound SB48-0235
(1R,5S)-8-(methylsulfonyl)-3-{[1-(2-thienylmethyl)-4-piperidyl]oxy}-8-azabicyclo[3.2.1]octane

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

SB48-0235

Molecular Formula

C18H28N2O3S2 (C18 H28 N2 O3 S2)

Compound Name

(1R,5S)-8-(methylsulfonyl)-3-{[1-(2-thienylmethyl)-4-piperidyl]oxy}-8-azabicyclo[3.2.1]octane

IUPAC name

(1R5S)-8-methanesulfonyl-3-({1-[(thiophen-2-yl)methyl]piperidin-4-yl}oxy)-8-azabicyclo[3.2.1]octane

SMILES

CS(N([C@H](CC1)C2)[C@@H]1CC2OC1CCN(Cc2cccs2)CC1)(=O)=O

InChI

InChI=1S/C18H28N2O3S2/c1-25(21,22)20-14-4-5-15(20)12-17(11-14)23-16-6-8-19(9-7-16)13-18-3-2-10-24-18/h2-3,10,14-17H,4-9,11-13H2,1H3/t14-,15+,17?

InChI Key

QDVKSJIRJNUYMA-FKEKPDDDSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.749

Distribution Coefficient, logD

-0.397

Water Solubility, LogSw

-2.07

Polar Surface Area

42.666

Acid Dissociation Constant (pKa)

25.09

Base Dissociation Constant (pKb)

8.51

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

77.78

SB48-0235 in Drug Discovery

Included in Screening Libraries

Ion Channels Focused Library (26372 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with SB48-0235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB48-0235?
Check Price and Availability of SB48-0235, 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 SB48-0235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB48-0235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB48-0235
  • 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 SB48-0235 available by request