D062-0136 Screening compound: N-[(4-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-4-propoxybenzamide

D062-0136 Screening compound: N-[(4-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-4-propoxybenzamide
D062-0136 Screening compound: N-[(4-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-4-propoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D062-0136
N-[(4-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-4-propoxybenzamide

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

D062-0136

Molecular Formula

C22H22ClNO3 (C22 H22 ClNO3)

Compound Name

N-[(4-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-4-propoxybenzamide

IUPAC name

N-[(4-chlorophenyl)methyl]-N-[(furan-2-yl)methyl]-4-propoxybenzamide

SMILES

CCCOc(cc1)ccc1C(N(Cc1ccco1)Cc(cc1)ccc1Cl)=O

InChI

InChI=1S/C22H22ClNO3/c1-2-13-26-20-11-7-18(8-12-20)22(25)24(16-21-4-3-14-27-21)15-17-5-9-19(23)10-6-17/h3-12,14H,2,13,15-16H2,1H3

InChI Key

KHNUQSDVGRTLRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06646329

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.87

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

5.160

Distribution Coefficient, logD

5.160

Water Solubility, LogSw

-5.72

Polar Surface Area

31.344

Acid Dissociation Constant (pKa)

26.73

Base Dissociation Constant (pKb)

-6.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

D062-0136 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 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

References: we are preparing a list of scientific research reports with D062-0136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D062-0136?
Check Price and Availability of D062-0136, 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 D062-0136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D062-0136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D062-0136
  • 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 D062-0136 available by request