M308-1096 Screening compound: 3-(2-{[(5-methylfuran-2-yl)methyl]carbamoyl}ethyl)-N-phenylpiperidine-1-carboxamide

M308-1096 Screening compound: 3-(2-{[(5-methylfuran-2-yl)methyl]carbamoyl}ethyl)-N-phenylpiperidine-1-carboxamide
M308-1096 Screening compound: 3-(2-{[(5-methylfuran-2-yl)methyl]carbamoyl}ethyl)-N-phenylpiperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M308-1096
3-(2-{[(5-methylfuran-2-yl)methyl]carbamoyl}ethyl)-N-phenylpiperidine-1-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

M308-1096

Molecular Formula

C21H27N3O3 (C21 H27 N3 O3)

Compound Name

3-(2-{[(5-methylfuran-2-yl)methyl]carbamoyl}ethyl)-N-phenylpiperidine-1-carboxamide

IUPAC name

3-(2-{[(5-methylfuran-2-yl)methyl]carbamoyl}ethyl)-N-phenylpiperidine-1-carboxamide

SMILES

Cc1ccc(CNC(CCC(CCC2)CN2C(Nc2ccccc2)=O)=O)o1

InChI

InChI=1S/C21H27N3O3/c1-16-9-11-19(27-16)14-22-20(25)12-10-17-6-5-13-24(15-17)21(26)23-18-7-3-2-4-8-18/h2-4,7-9,11,17H,5-6,10,12-15H2,1H3,(H,22,25)(H,23,26)/t17-/m1/s1

InChI Key

QMUNYPYYDOBJTO-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD27535670

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.398

Distribution Coefficient, logD

3.398

Water Solubility, LogSw

-3.61

Polar Surface Area

57.104

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

2.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.90

M308-1096 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 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

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

References: we are preparing a list of scientific research reports with M308-1096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M308-1096?
Check Price and Availability of M308-1096, 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 M308-1096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M308-1096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M308-1096
  • 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 M308-1096 available by request