M678-0165 Screening compound: N-(2-{2-[1-(4-methoxybenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)acetamide

M678-0165 Screening compound: N-(2-{2-[1-(4-methoxybenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)acetamide
M678-0165 Screening compound: N-(2-{2-[1-(4-methoxybenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M678-0165
N-(2-{2-[1-(4-methoxybenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)acetamide

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

M678-0165

Molecular Formula

C20H25N3O3S (C20 H25 N3 O3 S)

Compound Name

N-(2-{2-[1-(4-methoxybenzoyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)acetamide

IUPAC name

N-(2-{2-[1-(4-methoxybenzoyl)piperidin-3-yl]-13-thiazol-4-yl}ethyl)acetamide

SMILES

CC(NCCc1csc(C(CCC2)CN2C(c(cc2)ccc2OC)=O)n1)=O

InChI

InChI=1S/C20H25N3O3S/c1-14(24)21-10-9-17-13-27-19(22-17)16-4-3-11-23(12-16)20(25)15-5-7-18(26-2)8-6-15/h5-8,13,16H,3-4,9-12H2,1-2H3,(H,21,24)/t16-/m0/s1

InChI Key

ARPQDNSKDPVTIP-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27551221

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.652

Distribution Coefficient, logD

1.652

Water Solubility, LogSw

-2.18

Polar Surface Area

59.019

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.00

M678-0165 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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
Structure:
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with M678-0165 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M678-0165?
Check Price and Availability of M678-0165, 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 M678-0165 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M678-0165
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M678-0165
  • 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 M678-0165 available by request