8006-5466 Screening compound: N-[4-(benzyloxy)phenyl]-3-(4-phenylpiperazin-1-yl)propanamide

8006-5466 Screening compound: N-[4-(benzyloxy)phenyl]-3-(4-phenylpiperazin-1-yl)propanamide
8006-5466 Screening compound: N-[4-(benzyloxy)phenyl]-3-(4-phenylpiperazin-1-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-5466
N-[4-(benzyloxy)phenyl]-3-(4-phenylpiperazin-1-yl)propanamide

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

8006-5466

Molecular Formula

C26H29N3O2 (C26 H29 N3 O2)

Compound Name

N-[4-(benzyloxy)phenyl]-3-(4-phenylpiperazin-1-yl)propanamide

IUPAC name

N-[4-(benzyloxy)phenyl]-3-(4-phenylpiperazin-1-yl)propanamide

SMILES

O=C(CCN(CC1)CCN1c1ccccc1)Nc(cc1)ccc1OCc1ccccc1

InChI

InChI=1S/C26H29N3O2/c30-26(15-16-28-17-19-29(20-18-28)24-9-5-2-6-10-24)27-23-11-13-25(14-12-23)31-21-22-7-3-1-4-8-22/h1-14H,15-21H2,(H,27,30)

InChI Key

JDXXSQANIQRGPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00763972

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.276

Distribution Coefficient, logD

4.228

Water Solubility, LogSw

-4.28

Polar Surface Area

37.587

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

6.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

8006-5466 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Human GPCR Annotated Library (5539 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 8006-5466 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-5466?
Check Price and Availability of 8006-5466, 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 8006-5466 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-5466
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-5466
  • 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 8006-5466 available by request