CM3034-2122 Screening compound: [2-(1-METHYL-4-PIPERIDYL)-8-OXA-2-AZASPIRO[4.5]DEC-4-YL]METHYL PHENYL ETHER

CM3034-2122 Screening compound: [2-(1-METHYL-4-PIPERIDYL)-8-OXA-2-AZASPIRO[4.5]DEC-4-YL]METHYL PHENYL ETHER
CM3034-2122 Screening compound: [2-(1-METHYL-4-PIPERIDYL)-8-OXA-2-AZASPIRO[4.5]DEC-4-YL]METHYL PHENYL ETHER alternative view

Chemical Structure Depiction of ChemDiv screening compound CM3034-2122
[2-(1-METHYL-4-PIPERIDYL)-8-OXA-2-AZASPIRO[4.5]DEC-4-YL]METHYL PHENYL ETHER

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

CM3034-2122

Molecular Formula

C21H32N2O2 (C21 H32 N2 O2)

Compound Name

[2-(1-METHYL-4-PIPERIDYL)-8-OXA-2-AZASPIRO[4.5]DEC-4-YL]METHYL PHENYL ETHER

IUPAC name

2-(1-methylpiperidin-4-yl)-4-(phenoxymethyl)-8-oxa-2-azaspiro[4.5]decane

SMILES

CN(CC1)CCC1N1CC2(CCOCC2)C(COc2ccccc2)C1

InChI

InChI=1S/C21H32N2O2/c1-22-11-7-19(8-12-22)23-15-18(16-25-20-5-3-2-4-6-20)21(17-23)9-13-24-14-10-21/h2-6,18-19H,7-17H2,1H3/t18-/m1/s1

InChI Key

FGVKHKSVKUVGQN-GOSISDBHSA-N

MDL Number (MFCD)

MFCD30459469

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.540

Distribution Coefficient, logD

-0.916

Water Solubility, LogSw

-2.36

Polar Surface Area

22.290

Acid Dissociation Constant (pKa)

27.78

Base Dissociation Constant (pKb)

10.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

71.43

CM3034-2122 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with CM3034-2122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM3034-2122?
Check Price and Availability of CM3034-2122, 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 CM3034-2122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM3034-2122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM3034-2122
  • 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 CM3034-2122 available by request