M739-0411 Screening compound: cyclohexyl(2-{[4-(morpholinocarbonyl)phenoxy]methyl}-1-pyrrolidinyl)methanone

M739-0411 Screening compound: cyclohexyl(2-{[4-(morpholinocarbonyl)phenoxy]methyl}-1-pyrrolidinyl)methanone
M739-0411 Screening compound: cyclohexyl(2-{[4-(morpholinocarbonyl)phenoxy]methyl}-1-pyrrolidinyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound M739-0411
cyclohexyl(2-{[4-(morpholinocarbonyl)phenoxy]methyl}-1-pyrrolidinyl)methanone

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

M739-0411

Molecular Formula

C23H32N2O4 (C23 H32 N2 O4)

Compound Name

cyclohexyl(2-{[4-(morpholinocarbonyl)phenoxy]methyl}-1-pyrrolidinyl)methanone

IUPAC name

4-{4-[(1-cyclohexanecarbonylpyrrolidin-2-yl)methoxy]benzoyl}morpholine

SMILES

O=C(C1CCCCC1)N1C(COc(cc2)ccc2C(N2CCOCC2)=O)CCC1

InChI

InChI=1S/C23H32N2O4/c26-22(24-13-15-28-16-14-24)19-8-10-21(11-9-19)29-17-20-7-4-12-25(20)23(27)18-5-2-1-3-6-18/h8-11,18,20H,1-7,12-17H2/t20-/m1/s1

InChI Key

APTSLVCEPFDCRO-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD27552331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.628

Distribution Coefficient, logD

2.628

Water Solubility, LogSw

-2.69

Polar Surface Area

48.875

Acid Dissociation Constant (pKa)

23.92

Base Dissociation Constant (pKb)

-2.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

65.22

M739-0411 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M739-0411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M739-0411?
Check Price and Availability of M739-0411, 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 M739-0411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M739-0411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M739-0411
  • 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 M739-0411 available by request