G856-5166 Screening compound: ethyl 1-[(7,8-dimethyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate

G856-5166 Screening compound: ethyl 1-[(7,8-dimethyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate
G856-5166 Screening compound: ethyl 1-[(7,8-dimethyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-5166
ethyl 1-[(7,8-dimethyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate

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

G856-5166

Molecular Formula

C20H25NO4 (C20 H25 NO4)

Compound Name

ethyl 1-[(7,8-dimethyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[(78-dimethyl-2-oxo-2H-chromen-4-yl)methyl]piperidine-4-carboxylate

SMILES

CCOC(C1CCN(CC(c(ccc(C)c2C)c2O2)=CC2=O)CC1)=O

InChI

InChI=1S/C20H25NO4/c1-4-24-20(23)15-7-9-21(10-8-15)12-16-11-18(22)25-19-14(3)13(2)5-6-17(16)19/h5-6,11,15H,4,7-10,12H2,1-3H3

InChI Key

QYEWEQCYQIUCTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04612424

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.377

Distribution Coefficient, logD

2.097

Water Solubility, LogSw

-3.53

Polar Surface Area

44.816

Acid Dissociation Constant (pKa)

23.55

Base Dissociation Constant (pKb)

8.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

G856-5166 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Cancer
  • Immune system
Targets:
  • GPCR
  • Ion Channels
  • Others

References: we are preparing a list of scientific research reports with G856-5166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-5166?
Check Price and Availability of G856-5166, 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 G856-5166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-5166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-5166
  • 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 G856-5166 available by request