D154-0428 Screening compound: 4-{[benzyl(methyl)amino]methyl}-6-methoxy-2H-chromen-2-one

D154-0428 Screening compound: 4-{[benzyl(methyl)amino]methyl}-6-methoxy-2H-chromen-2-one
D154-0428 Screening compound: 4-{[benzyl(methyl)amino]methyl}-6-methoxy-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D154-0428
4-{[benzyl(methyl)amino]methyl}-6-methoxy-2H-chromen-2-one

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

D154-0428

Molecular Formula

C19H19NO3 (C19 H19 NO3)

Compound Name

4-{[benzyl(methyl)amino]methyl}-6-methoxy-2H-chromen-2-one

IUPAC name

4-{[benzyl(methyl)amino]methyl}-6-methoxy-2H-chromen-2-one

SMILES

CN(Cc1ccccc1)CC(c(cc(cc1)OC)c1O1)=CC1=O

InChI

InChI=1S/C19H19NO3/c1-20(12-14-6-4-3-5-7-14)13-15-10-19(21)23-18-9-8-16(22-2)11-17(15)18/h3-11H,12-13H2,1-2H3

InChI Key

MZFDMHGTJLIQCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07397668

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

309.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.013

Distribution Coefficient, logD

2.962

Water Solubility, LogSw

-3.50

Polar Surface Area

32.034

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

6.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D154-0428 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

BRD4 Targeted Library (4534 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Others
  • GPCR
  • Ion Channels
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D154-0428 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D154-0428?
Check Price and Availability of D154-0428, 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 D154-0428 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D154-0428
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D154-0428
  • 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 D154-0428 available by request