Screening compound: InChI=1S/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2

Screening compound: InChI=1S/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2
Screening compound: InChI=1S/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2

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

T500-0030

Molecular Formula

C17H22FNO2 (C17 H22 FNO2)

Compound Name

2-(2-fluorophenyl)-1-{1-oxa-9-azaspiro[5.5]undecan-9-yl}ethan-1-one

IUPAC name

2-(2-fluorophenyl)-1-{1-oxa-9-azaspiro[5.5]undecan-9-yl}ethan-1-one

SMILES

O=C(Cc(cccc1)c1F)N(CC1)CCC11OCCCC1

InChI

InChI=1S/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2

InChI Key

OKOOSWANAKQJMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30463374

InChI=1S/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 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

Structure:
  • 3D
  • Fragments
  • Cyclic compounds
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with InChI=1S/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2 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/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2
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/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2
  • 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/C17H22FNO2/c18-15-6-2-1-5-14(15)13-16(20)19-10-8-17(9-11-19)7-3-4-12-21-17/h1-2,5-6H,3-4,7-13H2 available by request