M676-0731 Screening compound: N-({2-[1-(2-fluorobenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)cyclobutanecarboxamide

M676-0731 Screening compound: N-({2-[1-(2-fluorobenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)cyclobutanecarboxamide
M676-0731 Screening compound: N-({2-[1-(2-fluorobenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M676-0731
N-({2-[1-(2-fluorobenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)cyclobutanecarboxamide

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

M676-0731

Molecular Formula

C21H24FN3O2S (C21 H24 FN3 O2 S)

Compound Name

N-({2-[1-(2-fluorobenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}methyl)cyclobutanecarboxamide

IUPAC name

N-({2-[1-(2-fluorobenzoyl)piperidin-3-yl]-13-thiazol-4-yl}methyl)cyclobutanecarboxamide

SMILES

O=C(C1CCC1)NCc1csc(C(CCC2)CN2C(c(cccc2)c2F)=O)n1

InChI

InChI=1S/C21H24FN3O2S/c22-18-9-2-1-8-17(18)21(27)25-10-4-7-15(12-25)20-24-16(13-28-20)11-23-19(26)14-5-3-6-14/h1-2,8-9,13-15H,3-7,10-12H2,(H,23,26)/t15-/m0/s1

InChI Key

XAIVGSKUQJKXQU-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27550853

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.294

Distribution Coefficient, logD

2.294

Water Solubility, LogSw

-2.89

Polar Surface Area

51.986

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

1.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.62

M676-0731 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M676-0731 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M676-0731?
Check Price and Availability of M676-0731, 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 M676-0731 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M676-0731
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M676-0731
  • 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 M676-0731 available by request