M308-0712 Screening compound: N-(3-fluorophenyl)-3-(2-{[(2-methoxyphenyl)methyl]carbamoyl}ethyl)piperidine-1-carboxamide

M308-0712 Screening compound: N-(3-fluorophenyl)-3-(2-{[(2-methoxyphenyl)methyl]carbamoyl}ethyl)piperidine-1-carboxamide
M308-0712 Screening compound: N-(3-fluorophenyl)-3-(2-{[(2-methoxyphenyl)methyl]carbamoyl}ethyl)piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M308-0712
N-(3-fluorophenyl)-3-(2-{[(2-methoxyphenyl)methyl]carbamoyl}ethyl)piperidine-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

M308-0712

Molecular Formula

C23H28FN3O3 (C23 H28 FN3 O3)

Compound Name

N-(3-fluorophenyl)-3-(2-{[(2-methoxyphenyl)methyl]carbamoyl}ethyl)piperidine-1-carboxamide

IUPAC name

N-(3-fluorophenyl)-3-(2-{[(2-methoxyphenyl)methyl]carbamoyl}ethyl)piperidine-1-carboxamide

SMILES

COc1c(CNC(CCC(CCC2)CN2C(Nc2cccc(F)c2)=O)=O)cccc1

InChI

InChI=1S/C23H28FN3O3/c1-30-21-10-3-2-7-18(21)15-25-22(28)12-11-17-6-5-13-27(16-17)23(29)26-20-9-4-8-19(24)14-20/h2-4,7-10,14,17H,5-6,11-13,15-16H2,1H3,(H,25,28)(H,26,29)/t17-/m1/s1

InChI Key

MEQRSRFBRPMTJS-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD27535614

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.907

Distribution Coefficient, logD

3.907

Water Solubility, LogSw

-4.07

Polar Surface Area

57.471

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

1.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

M308-0712 in Drug Discovery

Included in Screening Libraries

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

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 M308-0712 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M308-0712?
Check Price and Availability of M308-0712, 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 M308-0712 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M308-0712
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M308-0712
  • 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 M308-0712 available by request