M216-0076 Screening compound: N-(3-methoxyphenyl)-1-[3-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]piperidine-3-carboxamide

M216-0076 Screening compound: N-(3-methoxyphenyl)-1-[3-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]piperidine-3-carboxamide
M216-0076 Screening compound: N-(3-methoxyphenyl)-1-[3-(4-methylphenyl)-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M216-0076
N-(3-methoxyphenyl)-1-[3-(4-methylphenyl)-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

M216-0076

Molecular Formula

C26H26N4O3S (C26 H26 N4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1N(C1=O)C(N(CCC2)CC2C(Nc2cc(OC)ccc2)=O)=Nc2c1scc2

InChI

InChI=1S/C26H26N4O3S/c1-17-8-10-20(11-9-17)30-25(32)23-22(12-14-34-23)28-26(30)29-13-4-5-18(16-29)24(31)27-19-6-3-7-21(15-19)33-2/h3,6-12,14-15,18H,4-5,13,16H2,1-2H3,(H,27,31)/t18-/m0/s1

InChI Key

AOPGRZFMDWBFRM-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27534418

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.106

Distribution Coefficient, logD

4.106

Water Solubility, LogSw

-4.27

Polar Surface Area

59.798

Acid Dissociation Constant (pKa)

11.02

Base Dissociation Constant (pKb)

2.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.90

M216-0076 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics
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 M216-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M216-0076?
Check Price and Availability of M216-0076, 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 M216-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M216-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M216-0076
  • 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 M216-0076 available by request