M678-0105 Screening compound: N-(2-{2-[1-(22-DIMETHYLBUTANOYL)PIPERIDIN-3-YL]-13-THIAZOL-4-YL}ETHYL)ACETAMIDE

M678-0105 Screening compound: N-(2-{2-[1-(22-DIMETHYLBUTANOYL)PIPERIDIN-3-YL]-13-THIAZOL-4-YL}ETHYL)ACETAMIDE
M678-0105 Screening compound: N-(2-{2-[1-(22-DIMETHYLBUTANOYL)PIPERIDIN-3-YL]-13-THIAZOL-4-YL}ETHYL)ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound M678-0105
N-(2-{2-[1-(22-DIMETHYLBUTANOYL)PIPERIDIN-3-YL]-13-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

M678-0105

Molecular Formula

C18H29N3O2S (C18 H29 N3 O2 S)

Compound Name

N-(2-{2-[1-(22-DIMETHYLBUTANOYL)PIPERIDIN-3-YL]-13-THIAZOL-4-YL}ETHYL)ACETAMIDE

IUPAC name

N-(2-{2-[1-(22-dimethylbutanoyl)piperidin-3-yl]-13-thiazol-4-yl}ethyl)acetamide

SMILES

CCC(C)(C)C(N(CCC1)CC1c1nc(CCNC(C)=O)cs1)=O

InChI

InChI=1S/C18H29N3O2S/c1-5-18(3,4)17(23)21-10-6-7-14(11-21)16-20-15(12-24-16)8-9-19-13(2)22/h12,14H,5-11H2,1-4H3,(H,19,22)/t14-/m0/s1

InChI Key

FNUBRQKLBXQPIQ-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27551198

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.51

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

2.345

Distribution Coefficient, logD

2.345

Water Solubility, LogSw

-2.45

Polar Surface Area

51.746

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

4.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

72.22

M678-0105 in Drug Discovery

Included in Screening Libraries

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 M678-0105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M678-0105?
Check Price and Availability of M678-0105, 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 M678-0105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M678-0105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M678-0105
  • 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 M678-0105 available by request