M678-0515 Screening compound: N~1~-(2-{2-[1-(cyclopentylcarbonyl)-3-piperidyl]-1,3-thiazol-4-yl}ethyl)-1-cyclobutanecarboxamide

M678-0515 Screening compound: N~1~-(2-{2-[1-(cyclopentylcarbonyl)-3-piperidyl]-1,3-thiazol-4-yl}ethyl)-1-cyclobutanecarboxamide
M678-0515 Screening compound: N~1~-(2-{2-[1-(cyclopentylcarbonyl)-3-piperidyl]-1,3-thiazol-4-yl}ethyl)-1-cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M678-0515
N~1~-(2-{2-[1-(cyclopentylcarbonyl)-3-piperidyl]-1,3-thiazol-4-yl}ethyl)-1-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

M678-0515

Molecular Formula

C21H31N3O2S (C21 H31 N3 O2 S)

Compound Name

N~1~-(2-{2-[1-(cyclopentylcarbonyl)-3-piperidyl]-1,3-thiazol-4-yl}ethyl)-1-cyclobutanecarboxamide

IUPAC name

N-{2-[2-(1-cyclopentanecarbonylpiperidin-3-yl)-13-thiazol-4-yl]ethyl}cyclobutanecarboxamide

SMILES

O=C(C1CCC1)NCCc1csc(C(CCC2)CN2C(C2CCCC2)=O)n1

InChI

InChI=1S/C21H31N3O2S/c25-19(15-7-3-8-15)22-11-10-18-14-27-20(23-18)17-9-4-12-24(13-17)21(26)16-5-1-2-6-16/h14-17H,1-13H2,(H,22,25)/t17-/m0/s1

InChI Key

CKGUDNOGDOSSLN-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27551378

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.56

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

2.494

Distribution Coefficient, logD

2.494

Water Solubility, LogSw

-2.59

Polar Surface Area

52.385

Acid Dissociation Constant (pKa)

14.47

Base Dissociation Constant (pKb)

4.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

76.19

M678-0515 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M678-0515 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M678-0515?
Check Price and Availability of M678-0515, 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 M678-0515 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M678-0515
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M678-0515
  • 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 M678-0515 available by request