8009-4417 Screening compound: 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxypropan-2-ol

8009-4417 Screening compound: 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxypropan-2-ol
8009-4417 Screening compound: 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxypropan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-4417
1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxypropan-2-ol

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

8009-4417

Molecular Formula

C19H23N3O4 (C19 H23 N3 O4)

Compound Name

1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxypropan-2-ol

IUPAC name

1-[4-(4-nitrophenyl)piperazin-1-yl]-3-phenoxypropan-2-ol

SMILES

[O-][N+](c(cc1)ccc1N1CCN(CC(COc2ccccc2)O)CC1)=O

InChI

InChI=1S/C19H23N3O4/c23-18(15-26-19-4-2-1-3-5-19)14-20-10-12-21(13-11-20)16-6-8-17(9-7-16)22(24)25/h1-9,18,23H,10-15H2/t18-/m0/s1

InChI Key

JPJOVOODFZGOBN-SFHVURJKSA-N

MDL Number (MFCD)

MFCD00813622

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.086

Distribution Coefficient, logD

3.028

Water Solubility, LogSw

-3.12

Polar Surface Area

64.731

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

6.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.80

8009-4417 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with 8009-4417 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-4417?
Check Price and Availability of 8009-4417, 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 8009-4417 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-4417
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-4417
  • 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 8009-4417 available by request