M106-0014 Screening compound: 1-(2-methylthieno[3,2-c]pyridin-4-yl)-N-[2-(trifluoromethyl)phenyl]-3-piperidinecarboxamide

M106-0014 Screening compound: 1-(2-methylthieno[3,2-c]pyridin-4-yl)-N-[2-(trifluoromethyl)phenyl]-3-piperidinecarboxamide
M106-0014 Screening compound: 1-(2-methylthieno[3,2-c]pyridin-4-yl)-N-[2-(trifluoromethyl)phenyl]-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M106-0014
1-(2-methylthieno[3,2-c]pyridin-4-yl)-N-[2-(trifluoromethyl)phenyl]-3-piperidinecarboxamide

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

M106-0014

Molecular Formula

C21H20F3N3OS (C21 H20 F3 N3 OS)

Compound Name

1-(2-methylthieno[3,2-c]pyridin-4-yl)-N-[2-(trifluoromethyl)phenyl]-3-piperidinecarboxamide

IUPAC name

1-{2-methylthieno[32-c]pyridin-4-yl}-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide

SMILES

Cc1cc(c(N(CCC2)CC2C(Nc2c(C(F)(F)F)cccc2)=O)ncc2)c2s1

InChI

InChI=1S/C21H20F3N3OS/c1-13-11-15-18(29-13)8-9-25-19(15)27-10-4-5-14(12-27)20(28)26-17-7-3-2-6-16(17)21(22,23)24/h2-3,6-9,11,14H,4-5,10,12H2,1H3,(H,26,28)/t14-/m0/s1

InChI Key

WELQRZBYPNPAJR-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD15140824

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.015

Distribution Coefficient, logD

4.411

Water Solubility, LogSw

-4.65

Polar Surface Area

35.745

Acid Dissociation Constant (pKa)

11.63

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.33

M106-0014 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 M106-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M106-0014?
Check Price and Availability of M106-0014, 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 M106-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M106-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M106-0014
  • 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 M106-0014 available by request