M677-0440 Screening compound: N-(2-{2-[1-(2,5-difluorobenzoyl)piperidin-4-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide

M677-0440 Screening compound: N-(2-{2-[1-(2,5-difluorobenzoyl)piperidin-4-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide
M677-0440 Screening compound: N-(2-{2-[1-(2,5-difluorobenzoyl)piperidin-4-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M677-0440
N-(2-{2-[1-(2,5-difluorobenzoyl)piperidin-4-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

M677-0440

Molecular Formula

C21H23F2N3O2S (C21 H23 F2 N3 O2 S)

Compound Name

N-(2-{2-[1-(2,5-difluorobenzoyl)piperidin-4-yl]-1,3-thiazol-4-yl}ethyl)cyclopropanecarboxamide

IUPAC name

N-(2-{2-[1-(25-difluorobenzoyl)piperidin-4-yl]-13-thiazol-4-yl}ethyl)cyclopropanecarboxamide

SMILES

O=C(C1CC1)NCCc1csc(C(CC2)CCN2C(c(cc(cc2)F)c2F)=O)n1

InChI

InChI=1S/C21H23F2N3O2S/c22-15-3-4-18(23)17(11-15)21(28)26-9-6-14(7-10-26)20-25-16(12-29-20)5-8-24-19(27)13-1-2-13/h3-4,11-14H,1-2,5-10H2,(H,24,27)

InChI Key

PYEXEYLWLSTKAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27551066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.5

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

3.107

Distribution Coefficient, logD

3.107

Water Solubility, LogSw

-3.44

Polar Surface Area

51.894

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

3.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

M677-0440 in Drug Discovery

Included in Screening Libraries

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
Structure:
  • Mimetics
  • Cyclic compounds
  • Mimetics

References: we are preparing a list of scientific research reports with M677-0440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M677-0440?
Check Price and Availability of M677-0440, 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 M677-0440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M677-0440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M677-0440
  • 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 M677-0440 available by request