M747-3581 Screening compound: N-{2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl}-N-methylfuran-3-carboxamide

M747-3581 Screening compound: N-{2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl}-N-methylfuran-3-carboxamide
M747-3581 Screening compound: N-{2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl}-N-methylfuran-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M747-3581
N-{2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl}-N-methylfuran-3-carboxamide

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

M747-3581

Molecular Formula

C16H24N2O4 (C16 H24 N2 O4)

Compound Name

N-{2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl}-N-methylfuran-3-carboxamide

IUPAC name

N-{2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl}-N-methylfuran-3-carboxamide

SMILES

CN(CC(N1CCC(CCOC)CC1)=O)C(c1cocc1)=O

InChI

InChI=1S/C16H24N2O4/c1-17(16(20)14-6-10-22-12-14)11-15(19)18-7-3-13(4-8-18)5-9-21-2/h6,10,12-13H,3-5,7-9,11H2,1-2H3

InChI Key

HZVFWYBQQFIFSU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030068

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.801

Distribution Coefficient, logD

0.801

Water Solubility, LogSw

-1.42

Polar Surface Area

48.927

Acid Dissociation Constant (pKa)

22.94

Base Dissociation Constant (pKb)

1.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

62.50

M747-3581 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M747-3581 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M747-3581?
Check Price and Availability of M747-3581, 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 M747-3581 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M747-3581
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M747-3581
  • 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 M747-3581 available by request