S810-0232 Screening compound: 1-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(propane-2-sulfonyl)-6-azaspiro[2.5]octane

S810-0232 Screening compound: 1-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(propane-2-sulfonyl)-6-azaspiro[2.5]octane
S810-0232 Screening compound: 1-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(propane-2-sulfonyl)-6-azaspiro[2.5]octane alternative view

Chemical Structure Depiction of ChemDiv screening compound S810-0232
1-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(propane-2-sulfonyl)-6-azaspiro[2.5]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

S810-0232

Molecular Formula

C13H21N3O3S (C13 H21 N3 O3 S)

Compound Name

1-(5-methyl-1,2,4-oxadiazol-3-yl)-6-(propane-2-sulfonyl)-6-azaspiro[2.5]octane

IUPAC name

1-(5-methyl-124-oxadiazol-3-yl)-6-(propane-2-sulfonyl)-6-azaspiro[2.5]octane

SMILES

CC(C)S(N(CC1)CCC1(C1)C1c1noc(C)n1)(=O)=O

InChI

InChI=1S/C13H21N3O3S/c1-9(2)20(17,18)16-6-4-13(5-7-16)8-11(13)12-14-10(3)19-15-12/h9,11H,4-8H2,1-3H3/t11-/m0/s1

InChI Key

QKVVKEFORYIETC-NSHDSACASA-N

MDL Number (MFCD)

MFCD32228378

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.597

Distribution Coefficient, logD

1.597

Water Solubility, LogSw

-1.71

Polar Surface Area

63.378

Acid Dissociation Constant (pKa)

19.76

Base Dissociation Constant (pKb)

0.97

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

84.61

S810-0232 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S810-0232 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S810-0232?
Check Price and Availability of S810-0232, 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 S810-0232 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S810-0232
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S810-0232
  • 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 S810-0232 available by request