Screening compound: InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2

Screening compound: InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2
Screening compound: InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2

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

T500-1864

Molecular Formula

C20H28N2O3S (C20 H28 N2 O3 S)

Compound Name

9-[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]-1-oxa-9-azaspiro[5.5]undecane

IUPAC name

9-[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]-1-oxa-9-azaspiro[5.5]undecane

SMILES

O=C(C(CC1)CCN1C(c1cccs1)=O)N(CC1)CCC11OCCCC1

InChI

InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2

InChI Key

JFWJPQYIQSNWGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32000687

InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

KRAS-Targeted Library (16000 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2
  • 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 InChI=1S/C20H28N2O3S/c23-18(22-12-8-20(9-13-22)7-1-2-14-25-20)16-5-10-21(11-6-16)19(24)17-4-3-15-26-17/h3-4,15-16H,1-2,5-14H2 available by request