M216-0338 Screening compound: N-cyclohexyl-1-{3-[(4-fluorophenyl)methyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl}piperidine-3-carboxamide

M216-0338 Screening compound: N-cyclohexyl-1-{3-[(4-fluorophenyl)methyl]-4-oxo-3H,4H-thieno[3,2-d]pyrimidin-2-yl}piperidine-3-carboxamide
M216-0338 Screening compound: N-cyclohexyl-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 M216-0338
N-cyclohexyl-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

M216-0338

Molecular Formula

C25H29FN4O2S (C25 H29 FN4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(C(CCC1)CN1C(N(Cc(cc1)ccc1F)C1=O)=Nc2c1scc2)NC1CCCCC1

InChI

InChI=1S/C25H29FN4O2S/c26-19-10-8-17(9-11-19)15-30-24(32)22-21(12-14-33-22)28-25(30)29-13-4-5-18(16-29)23(31)27-20-6-2-1-3-7-20/h8-12,14,18,20H,1-7,13,15-16H2,(H,27,31)/t18-/m0/s1

InChI Key

UDURPVFSQNAMDS-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27534534

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.260

Distribution Coefficient, logD

4.260

Water Solubility, LogSw

-4.14

Polar Surface Area

53.913

Acid Dissociation Constant (pKa)

14.96

Base Dissociation Constant (pKb)

1.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

M216-0338 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 M216-0338 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M216-0338?
Check Price and Availability of M216-0338, 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 M216-0338 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M216-0338
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M216-0338
  • 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 M216-0338 available by request