CM2345-3042 Screening compound: N-({2-[(2-CHLORO-3,4-DIMETHOXYPHENYL)METHYL]-2-AZASPIRO[4.5]DECAN-4-YL}METHYL)-2-METHOXYACETAMIDE

CM2345-3042 Screening compound: N-({2-[(2-CHLORO-3,4-DIMETHOXYPHENYL)METHYL]-2-AZASPIRO[4.5]DECAN-4-YL}METHYL)-2-METHOXYACETAMIDE
CM2345-3042 Screening compound: N-({2-[(2-CHLORO-3,4-DIMETHOXYPHENYL)METHYL]-2-AZASPIRO[4.5]DECAN-4-YL}METHYL)-2-METHOXYACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound CM2345-3042
N-({2-[(2-CHLORO-3,4-DIMETHOXYPHENYL)METHYL]-2-AZASPIRO[4.5]DECAN-4-YL}METHYL)-2-METHOXYACETAMIDE

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

CM2345-3042

Molecular Formula

C22H33ClN2O4 (C22 H33 ClN2 O4)

Compound Name

N-({2-[(2-CHLORO-3,4-DIMETHOXYPHENYL)METHYL]-2-AZASPIRO[4.5]DECAN-4-YL}METHYL)-2-METHOXYACETAMIDE

IUPAC name

n/a

SMILES

COCC(NCC(CN(Cc(c(Cl)c1OC)ccc1OC)C1)C11CCCCC1)=O

InChI

InChI=1S/C22H33ClN2O4/c1-27-14-19(26)24-11-17-13-25(15-22(17)9-5-4-6-10-22)12-16-7-8-18(28-2)21(29-3)20(16)23/h7-8,17H,4-6,9-15H2,1-3H3,(H,24,26)/t17-/m1/s1

InChI Key

MFHTUOOANRALGY-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD30458545

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.97

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.856

Distribution Coefficient, logD

-0.935

Water Solubility, LogSw

-3.69

Polar Surface Area

52.367

Acid Dissociation Constant (pKa)

14.19

Base Dissociation Constant (pKb)

11.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.20

CM2345-3042 in Drug Discovery

Included in Screening Libraries

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

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

References: we are preparing a list of scientific research reports with CM2345-3042 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM2345-3042?
Check Price and Availability of CM2345-3042, 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 CM2345-3042 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM2345-3042
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM2345-3042
  • 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 CM2345-3042 available by request