M106-0221 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-1-{2-methylthieno[3,2-c]pyridin-4-yl}piperidine-3-carboxamide

M106-0221 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-1-{2-methylthieno[3,2-c]pyridin-4-yl}piperidine-3-carboxamide
M106-0221 Screening compound: N-[(2-chloro-4-fluorophenyl)methyl]-1-{2-methylthieno[3,2-c]pyridin-4-yl}piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M106-0221
N-[(2-chloro-4-fluorophenyl)methyl]-1-{2-methylthieno[3,2-c]pyridin-4-yl}piperidine-3-carboxamide

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

M106-0221

Molecular Formula

C21H21ClFN3OS (C21 H21 ClFN3 OS)

Compound Name

N-[(2-chloro-4-fluorophenyl)methyl]-1-{2-methylthieno[3,2-c]pyridin-4-yl}piperidine-3-carboxamide

IUPAC name

N-[(2-chloro-4-fluorophenyl)methyl]-1-{2-methylthieno[32-c]pyridin-4-yl}piperidine-3-carboxamide

SMILES

Cc1cc(c(N(CCC2)CC2C(NCc(ccc(F)c2)c2Cl)=O)ncc2)c2s1

InChI

InChI=1S/C21H21ClFN3OS/c1-13-9-17-19(28-13)6-7-24-20(17)26-8-2-3-15(12-26)21(27)25-11-14-4-5-16(23)10-18(14)22/h4-7,9-10,15H,2-3,8,11-12H2,1H3,(H,25,27)/t15-/m0/s1

InChI Key

NTBLRRDNRXFPPZ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27496997

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.93

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

4.913

Distribution Coefficient, logD

4.309

Water Solubility, LogSw

-5.01

Polar Surface Area

37.765

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

M106-0221 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with M106-0221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M106-0221?
Check Price and Availability of M106-0221, 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 M106-0221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M106-0221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M106-0221
  • 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 M106-0221 available by request