S212-0297 Screening compound: 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(thiophene-2-sulfonyl)piperidine

S212-0297 Screening compound: 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(thiophene-2-sulfonyl)piperidine
S212-0297 Screening compound: 3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(thiophene-2-sulfonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound S212-0297
3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(thiophene-2-sulfonyl)piperidine

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

S212-0297

Molecular Formula

C13H17N3O4S2 (C13 H17 N3 O4 S2)

Compound Name

3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]-1-(thiophene-2-sulfonyl)piperidine

IUPAC name

3-[(3-methyl-124-oxadiazol-5-yl)methoxy]-1-(thiophene-2-sulfonyl)piperidine

SMILES

Cc1noc(COC(CCC2)CN2S(c2cccs2)(=O)=O)n1

InChI

InChI=1S/C13H17N3O4S2/c1-10-14-12(20-15-10)9-19-11-4-2-6-16(8-11)22(17,18)13-5-3-7-21-13/h3,5,7,11H,2,4,6,8-9H2,1H3/t11-/m0/s1

InChI Key

BRZSCBKESHWVLK-NSHDSACASA-N

MDL Number (MFCD)

MFCD29033399

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.128

Distribution Coefficient, logD

1.128

Water Solubility, LogSw

-2.12

Polar Surface Area

70.870

Acid Dissociation Constant (pKa)

26.30

Base Dissociation Constant (pKb)

-1.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.80

S212-0297 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Bcl2-PPI Inhibitors Library (12246 compounds)

CNS MPO Library (28609 compounds)

GPCR Targeted Library (31838 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Targets:
  • GPCR
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S212-0297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S212-0297?
Check Price and Availability of S212-0297, 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 S212-0297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S212-0297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S212-0297
  • 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 S212-0297 available by request