M216-0306 Screening compound: N-[(2-fluorophenyl)methyl]-1-{3-[(4-methylphenyl)methyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl}piperidine-3-carboxamide

M216-0306 Screening compound: N-[(2-fluorophenyl)methyl]-1-{3-[(4-methylphenyl)methyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl}piperidine-3-carboxamide
M216-0306 Screening compound: N-[(2-fluorophenyl)methyl]-1-{3-[(4-methylphenyl)methyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl}piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M216-0306
N-[(2-fluorophenyl)methyl]-1-{3-[(4-methylphenyl)methyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-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

M216-0306

Molecular Formula

C27H27FN4O2S (C27 H27 FN4 O2 S)

Compound Name

N-[(2-fluorophenyl)methyl]-1-{3-[(4-methylphenyl)methyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl}piperidine-3-carboxamide

IUPAC name

N-[(2-fluorophenyl)methyl]-1-{3-[(4-methylphenyl)methyl]-4-oxo-3H4H-thieno[32-d]pyrimidin-2-yl}piperidine-3-carboxamide

SMILES

Cc1ccc(CN(C2=O)C(N(CCC3)CC3C(NCc(cccc3)c3F)=O)=Nc3c2scc3)cc1

InChI

InChI=1S/C27H27FN4O2S/c1-18-8-10-19(11-9-18)16-32-26(34)24-23(12-14-35-24)30-27(32)31-13-4-6-21(17-31)25(33)29-15-20-5-2-3-7-22(20)28/h2-3,5,7-12,14,21H,4,6,13,15-17H2,1H3,(H,29,33)/t21-/m0/s1

InChI Key

RMTWYNYRBWNJKY-NRFANRHFSA-N

MDL Number (MFCD)

MFCD27534507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.578

Distribution Coefficient, logD

4.578

Water Solubility, LogSw

-4.23

Polar Surface Area

54.188

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

-1.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

M216-0306 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with M216-0306 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M216-0306?
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What is the minimum amount of M216-0306 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M216-0306
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M216-0306
  • 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 M216-0306 available by request