Screening compound: InChI=1S/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3

Screening compound: InChI=1S/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3
Screening compound: InChI=1S/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3

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

S509-1744

Molecular Formula

C21H36N2O3 (C21 H36 N2 O3)

Compound Name

3-(3-cyclopentylpropanoyl)-9-(2-methoxyethyl)-3,9-diazaspiro[5.6]dodecan-10-one

IUPAC name

3-(3-cyclopentylpropanoyl)-9-(2-methoxyethyl)-39-diazaspiro[5.6]dodecan-10-one

SMILES

COCCN(CCC(CC1)(CCN1C(CCC1CCCC1)=O)CC1)C1=O

InChI

InChI=1S/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3

InChI Key

XVSFJDPDKLBHFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31982919

InChI=1S/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Alpha-Helix Mimetics Library (25899 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
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with InChI=1S/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3 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/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3
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/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3
  • 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/C21H36N2O3/c1-26-17-16-23-15-12-21(9-8-20(23)25)10-13-22(14-11-21)19(24)7-6-18-4-2-3-5-18/h18H,2-17H2,1H3 available by request