M216-0346 Screening compound: N-(CYCLOPROPYLMETHYL)-1-{3-[(4-FLUOROPHENYL)METHYL]-4-OXO-3H,4H-THIENO[3,2-D]PYRIMIDIN-2-YL}PIPERIDINE-3-CARBOXAMIDE

M216-0346 Screening compound: N-(CYCLOPROPYLMETHYL)-1-{3-[(4-FLUOROPHENYL)METHYL]-4-OXO-3H,4H-THIENO[3,2-D]PYRIMIDIN-2-YL}PIPERIDINE-3-CARBOXAMIDE
M216-0346 Screening compound: N-(CYCLOPROPYLMETHYL)-1-{3-[(4-FLUOROPHENYL)METHYL]-4-OXO-3H,4H-THIENO[3,2-D]PYRIMIDIN-2-YL}PIPERIDINE-3-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound M216-0346
N-(CYCLOPROPYLMETHYL)-1-{3-[(4-FLUOROPHENYL)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

M216-0346

Molecular Formula

C23H25FN4O2S (C23 H25 FN4 O2 S)

Compound Name

N-(CYCLOPROPYLMETHYL)-1-{3-[(4-FLUOROPHENYL)METHYL]-4-OXO-3H,4H-THIENO[3,2-D]PYRIMIDIN-2-YL}PIPERIDINE-3-CARBOXAMIDE

IUPAC name

n/a

SMILES

O=C(C(CCC1)CN1C(N(Cc(cc1)ccc1F)C1=O)=Nc2c1scc2)NCC1CC1

InChI

InChI=1S/C23H25FN4O2S/c24-18-7-5-16(6-8-18)13-28-22(30)20-19(9-11-31-20)26-23(28)27-10-1-2-17(14-27)21(29)25-12-15-3-4-15/h5-9,11,15,17H,1-4,10,12-14H2,(H,25,29)/t17-/m0/s1

InChI Key

FFGQDNKCXVKAMF-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27534540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.54

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

3.465

Distribution Coefficient, logD

3.465

Water Solubility, LogSw

-3.62

Polar Surface Area

54.711

Acid Dissociation Constant (pKa)

15.40

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

M216-0346 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
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 M216-0346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M216-0346?
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What is the minimum amount of M216-0346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M216-0346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M216-0346
  • 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 M216-0346 available by request