6228-2497 Screening compound: 4-{5-[(2-bromophenoxy)methyl]furan-2-carbonyl}-2,6-dimethylmorpholine

6228-2497 Screening compound: 4-{5-[(2-bromophenoxy)methyl]furan-2-carbonyl}-2,6-dimethylmorpholine
6228-2497 Screening compound: 4-{5-[(2-bromophenoxy)methyl]furan-2-carbonyl}-2,6-dimethylmorpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6228-2497
4-{5-[(2-bromophenoxy)methyl]furan-2-carbonyl}-2,6-dimethylmorpholine

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

6228-2497

Molecular Formula

C18H20BrNO4 (C18 H20 BrNO4)

Compound Name

4-{5-[(2-bromophenoxy)methyl]furan-2-carbonyl}-2,6-dimethylmorpholine

IUPAC name

4-{5-[(2-bromophenoxy)methyl]furan-2-carbonyl}-26-dimethylmorpholine

SMILES

CC(C1)OC(C)CN1C(c1ccc(COc(cccc2)c2Br)o1)=O

InChI

InChI=1S/C18H20BrNO4/c1-12-9-20(10-13(2)23-12)18(21)17-8-7-14(24-17)11-22-16-6-4-3-5-15(16)19/h3-8,12-13H,9-11H2,1-2H3

InChI Key

YDIAQXXPUOPJHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02371438

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.298

Distribution Coefficient, logD

3.298

Water Solubility, LogSw

-3.55

Polar Surface Area

38.975

Acid Dissociation Constant (pKa)

26.37

Base Dissociation Constant (pKb)

-2.85

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

38.90

6228-2497 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6228-2497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6228-2497?
Check Price and Availability of 6228-2497, 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 6228-2497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6228-2497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6228-2497
  • 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 6228-2497 available by request