T822-2218 Screening compound: 1-[8-(2-chloro-4-fluorobenzoyl)-4-(hydroxymethyl)-2,8-diazaspiro[4.5]dec-2-yl]-1-ethanone

T822-2218 Screening compound: 1-[8-(2-chloro-4-fluorobenzoyl)-4-(hydroxymethyl)-2,8-diazaspiro[4.5]dec-2-yl]-1-ethanone
T822-2218 Screening compound: 1-[8-(2-chloro-4-fluorobenzoyl)-4-(hydroxymethyl)-2,8-diazaspiro[4.5]dec-2-yl]-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound T822-2218
1-[8-(2-chloro-4-fluorobenzoyl)-4-(hydroxymethyl)-2,8-diazaspiro[4.5]dec-2-yl]-1-ethanone

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

T822-2218

Molecular Formula

C18H22ClFN2O3 (C18 H22 ClFN2 O3)

Compound Name

1-[8-(2-chloro-4-fluorobenzoyl)-4-(hydroxymethyl)-2,8-diazaspiro[4.5]dec-2-yl]-1-ethanone

IUPAC name

1-[8-(2-chloro-4-fluorobenzoyl)-4-(hydroxymethyl)-28-diazaspiro[4.5]decan-2-yl]ethan-1-one

SMILES

CC(N1CC(CC2)(CCN2C(c(ccc(F)c2)c2Cl)=O)C(CO)C1)=O

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.194

Distribution Coefficient, logD

1.194

Water Solubility, LogSw

-2.81

Polar Surface Area

51.351

Acid Dissociation Constant (pKa)

15.87

Base Dissociation Constant (pKb)

7.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

T822-2218 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetics of Beta-Turn Motifs Library (2153 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with T822-2218 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T822-2218?
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What is the minimum amount of T822-2218 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T822-2218
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T822-2218
  • 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 T822-2218 available by request