CM2345-0426 Screening compound: {[2-(2,6-DIFLUOROBENZOYL)-2-AZASPIRO[4.5]DECAN-4-YL]METHYL}DIMETHYLAMINE

CM2345-0426 Screening compound: {[2-(2,6-DIFLUOROBENZOYL)-2-AZASPIRO[4.5]DECAN-4-YL]METHYL}DIMETHYLAMINE
CM2345-0426 Screening compound: {[2-(2,6-DIFLUOROBENZOYL)-2-AZASPIRO[4.5]DECAN-4-YL]METHYL}DIMETHYLAMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound CM2345-0426
{[2-(2,6-DIFLUOROBENZOYL)-2-AZASPIRO[4.5]DECAN-4-YL]METHYL}DIMETHYLAMINE

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

CM2345-0426

Molecular Formula

C19H26F2N2O (C19 H26 F2 N2 O)

Compound Name

{[2-(2,6-DIFLUOROBENZOYL)-2-AZASPIRO[4.5]DECAN-4-YL]METHYL}DIMETHYLAMINE

IUPAC name

{[2-(26-difluorobenzoyl)-2-azaspiro[4.5]decan-4-yl]methyl}dimethylamine

SMILES

CN(C)CC(CN(C1)C(c(c(F)ccc2)c2F)=O)C11CCCCC1

InChI

InChI=1S/C19H26F2N2O/c1-22(2)11-14-12-23(13-19(14)9-4-3-5-10-19)18(24)17-15(20)7-6-8-16(17)21/h6-8,14H,3-5,9-13H2,1-2H3/t14-/m1/s1

InChI Key

ITMHPJWXCDEFEG-CQSZACIVSA-N

MDL Number (MFCD)

MFCD30458500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.867

Distribution Coefficient, logD

0.843

Water Solubility, LogSw

-2.92

Polar Surface Area

20.927

Acid Dissociation Constant (pKa)

27.99

Base Dissociation Constant (pKb)

9.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.16

CM2345-0426 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 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

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

References: we are preparing a list of scientific research reports with CM2345-0426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM2345-0426?
Check Price and Availability of CM2345-0426, 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 CM2345-0426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM2345-0426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM2345-0426
  • 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 CM2345-0426 available by request