M678-0421 Screening compound: N-(2-{2-[1-(thiophene-3-carbonyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide

M678-0421 Screening compound: N-(2-{2-[1-(thiophene-3-carbonyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide
M678-0421 Screening compound: N-(2-{2-[1-(thiophene-3-carbonyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M678-0421
N-(2-{2-[1-(thiophene-3-carbonyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide

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

M678-0421

Molecular Formula

C19H23N3O2S2 (C19 H23 N3 O2 S2)

Compound Name

N-(2-{2-[1-(thiophene-3-carbonyl)piperidin-3-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide

IUPAC name

N-(2-{2-[1-(thiophene-3-carbonyl)piperidin-3-yl]-13-thiazol-4-yl}ethyl)cyclopropanecarboxamide

SMILES

O=C(C1CC1)NCCc1csc(C(CCC2)CN2C(c2cscc2)=O)n1

InChI

InChI=1S/C19H23N3O2S2/c23-17(13-3-4-13)20-7-5-16-12-26-18(21-16)14-2-1-8-22(10-14)19(24)15-6-9-25-11-15/h6,9,11-14H,1-5,7-8,10H2,(H,20,23)/t14-/m0/s1

InChI Key

SVIGTNRHHUMRRZ-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27551335

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.54

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

2.483

Distribution Coefficient, logD

2.483

Water Solubility, LogSw

-2.79

Polar Surface Area

52.846

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.60

M678-0421 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)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M678-0421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M678-0421?
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What is the minimum amount of M678-0421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M678-0421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M678-0421
  • 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 M678-0421 available by request