M678-0145 Screening compound: N-[2-(2-{1-[(2E)-3-(4-METHYLPHENYL)PROP-2-ENOYL]PIPERIDIN-3-YL}-1,3-THIAZOL-4-YL)ETHYL]ACETAMIDE

M678-0145 Screening compound: N-[2-(2-{1-[(2E)-3-(4-METHYLPHENYL)PROP-2-ENOYL]PIPERIDIN-3-YL}-1,3-THIAZOL-4-YL)ETHYL]ACETAMIDE
M678-0145 Screening compound: N-[2-(2-{1-[(2E)-3-(4-METHYLPHENYL)PROP-2-ENOYL]PIPERIDIN-3-YL}-1,3-THIAZOL-4-YL)ETHYL]ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound M678-0145
N-[2-(2-{1-[(2E)-3-(4-METHYLPHENYL)PROP-2-ENOYL]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

M678-0145

Molecular Formula

C22H27N3O2S (C22 H27 N3 O2 S)

Compound Name

N-[2-(2-{1-[(2E)-3-(4-METHYLPHENYL)PROP-2-ENOYL]PIPERIDIN-3-YL}-1,3-THIAZOL-4-YL)ETHYL]ACETAMIDE

IUPAC name

n/a

SMILES

CC(NCCc1csc(C(CCC2)CN2C(/C=C/c2ccc(C)cc2)=O)n1)=O

InChI

InChI=1S/C22H27N3O2S/c1-16-5-7-18(8-6-16)9-10-21(27)25-13-3-4-19(14-25)22-24-20(15-28-22)11-12-23-17(2)26/h5-10,15,19H,3-4,11-14H2,1-2H3,(H,23,26)/t19-/m0/s1

InChI Key

BGXPQBQLIJPNEP-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27551216

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.771

Distribution Coefficient, logD

2.771

Water Solubility, LogSw

-3.20

Polar Surface Area

50.948

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

3.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

M678-0145 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments
  • Mimetics
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with M678-0145 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M678-0145?
Check Price and Availability of M678-0145, 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 M678-0145 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M678-0145
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M678-0145
  • 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 M678-0145 available by request