T808-2858 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-8-oxa-2-azaspiro[4.5]decane-2-carboxamide

T808-2858 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
T808-2858 Screening compound: 4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-8-oxa-2-azaspiro[4.5]decane-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T808-2858
4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-8-oxa-2-azaspiro[4.5]decane-2-carboxamide

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

T808-2858

Molecular Formula

C18H21FN4O3 (C18 H21 FN4 O3)

Compound Name

4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-8-oxa-2-azaspiro[4.5]decane-2-carboxamide

IUPAC name

4-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]-N-methyl-8-oxa-2-azaspiro[4.5]decane-2-carboxamide

SMILES

CNC(N(C1)CC2(CCOCC2)C1c1nc(-c(cc2)ccc2F)no1)=O

InChI

InChI=1S/C18H21FN4O3/c1-20-17(24)23-10-14(18(11-23)6-8-25-9-7-18)16-21-15(22-26-16)12-2-4-13(19)5-3-12/h2-5,14H,6-11H2,1H3,(H,20,24)/t14-/m1/s1

InChI Key

AVGFYJMQDZDYJX-CQSZACIVSA-N

MDL Number (MFCD)

MFCD27623688

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.755

Distribution Coefficient, logD

2.755

Water Solubility, LogSw

-3.00

Polar Surface Area

66.919

Acid Dissociation Constant (pKa)

16.55

Base Dissociation Constant (pKb)

-0.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

T808-2858 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

Bcl2-PPI Inhibitors Library (12246 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Soluble Diversity Library (15920 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

New Agro Library (44492 compounds)

Peptidomimetics of Beta-Turn Motifs Library (2153 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Cyclic compounds
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with T808-2858 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T808-2858?
Check Price and Availability of T808-2858, 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 T808-2858 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T808-2858
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T808-2858
  • 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 T808-2858 available by request