M735-0962 Screening compound: 3-methoxy-4-[(3-{[2-(piperidine-1-carbonyl)phenoxy]methyl}piperidin-1-yl)methyl]phenol

M735-0962 Screening compound: 3-methoxy-4-[(3-{[2-(piperidine-1-carbonyl)phenoxy]methyl}piperidin-1-yl)methyl]phenol
M735-0962 Screening compound: 3-methoxy-4-[(3-{[2-(piperidine-1-carbonyl)phenoxy]methyl}piperidin-1-yl)methyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound M735-0962
3-methoxy-4-[(3-{[2-(piperidine-1-carbonyl)phenoxy]methyl}piperidin-1-yl)methyl]phenol

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

M735-0962

Molecular Formula

C26H34N2O4 (C26 H34 N2 O4)

Compound Name

3-methoxy-4-[(3-{[2-(piperidine-1-carbonyl)phenoxy]methyl}piperidin-1-yl)methyl]phenol

IUPAC name

3-methoxy-4-[(3-{[2-(piperidine-1-carbonyl)phenoxy]methyl}piperidin-1-yl)methyl]phenol

SMILES

COc1c(CN2CC(COc(cccc3)c3C(N3CCCCC3)=O)CCC2)ccc(O)c1

InChI

InChI=1S/C26H34N2O4/c1-31-25-16-22(29)12-11-21(25)18-27-13-7-8-20(17-27)19-32-24-10-4-3-9-23(24)26(30)28-14-5-2-6-15-28/h3-4,9-12,16,20,29H,2,5-8,13-15,17-19H2,1H3/t20-/m0/s1

InChI Key

RXRSBEDGSONXHV-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD31985763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.845

Distribution Coefficient, logD

2.817

Water Solubility, LogSw

-4.12

Polar Surface Area

53.114

Acid Dissociation Constant (pKa)

10.22

Base Dissociation Constant (pKb)

8.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

M735-0962 in Drug Discovery

Included in Screening Libraries

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

Bcl2-PPI Inhibitors Library (12246 compounds)

CNS Targets (44014 compounds)

KRAS-Targeted Library (16000 compounds)

MCL1 Targeted Library (12200 compounds)

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

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Proline Kinase Library (2105 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Mimetics
  • Mimetics
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with M735-0962 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M735-0962?
Check Price and Availability of M735-0962, 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 M735-0962 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M735-0962
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M735-0962
  • 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 M735-0962 available by request