D220-0464 Screening compound: N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenoxy)acetamide

D220-0464 Screening compound: N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenoxy)acetamide
D220-0464 Screening compound: N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D220-0464
N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenoxy)acetamide

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

D220-0464

Molecular Formula

C25H29NO3 (C25 H29 NO3)

Compound Name

N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenoxy)acetamide

IUPAC name

N-[(4-tert-butylphenyl)methyl]-N-[(furan-2-yl)methyl]-2-(3-methylphenoxy)acetamide

SMILES

CC(C)(C)c1ccc(CN(Cc2ccco2)C(COc2cc(C)ccc2)=O)cc1

InChI

InChI=1S/C25H29NO3/c1-19-7-5-8-22(15-19)29-18-24(27)26(17-23-9-6-14-28-23)16-20-10-12-21(13-11-20)25(2,3)4/h5-15H,16-18H2,1-4H3

InChI Key

WIHBLYJAZXXACI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07426405

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.704

Distribution Coefficient, logD

5.704

Water Solubility, LogSw

-5.48

Polar Surface Area

30.898

Acid Dissociation Constant (pKa)

24.07

Base Dissociation Constant (pKb)

-3.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

D220-0464 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

Antibacterial Compounds Library (13827 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:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D220-0464 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D220-0464?
Check Price and Availability of D220-0464, 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 D220-0464 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D220-0464
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D220-0464
  • 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 D220-0464 available by request