2616-1919 Screening compound: 2-(2-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one

2616-1919 Screening compound: 2-(2-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one
2616-1919 Screening compound: 2-(2-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2616-1919
2-(2-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one

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

2616-1919

Molecular Formula

C19H21N3O4 (C19 H21 N3 O4)

Compound Name

2-(2-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one

IUPAC name

2-(2-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one

SMILES

COc1c(CC(N(CC2)CCN2c(cc2)ccc2[N+]([O-])=O)=O)cccc1

InChI

InChI=1S/C19H21N3O4/c1-26-18-5-3-2-4-15(18)14-19(23)21-12-10-20(11-13-21)16-6-8-17(9-7-16)22(24)25/h2-9H,10-14H2,1H3

InChI Key

ZURWWOYAHFHQRR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01196726

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.180

Distribution Coefficient, logD

3.180

Water Solubility, LogSw

-3.42

Polar Surface Area

60.632

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

0.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

2616-1919 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 2616-1919 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2616-1919?
Check Price and Availability of 2616-1919, 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 2616-1919 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2616-1919
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2616-1919
  • 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 2616-1919 available by request