P123-0012 Screening compound: 4-tert-butyl-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}benzamide

P123-0012 Screening compound: 4-tert-butyl-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}benzamide
P123-0012 Screening compound: 4-tert-butyl-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P123-0012
4-tert-butyl-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}benzamide

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

P123-0012

Molecular Formula

C22H28N4O2 (C22 H28 N4 O2)

Compound Name

4-tert-butyl-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}benzamide

IUPAC name

4-tert-butyl-N-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}benzamide

SMILES

CC(C)(C)c(cc1)ccc1C(NCC(N(CC1)CCN1c1ncccc1)=O)=O

InChI

InChI=1S/C22H28N4O2/c1-22(2,3)18-9-7-17(8-10-18)21(28)24-16-20(27)26-14-12-25(13-15-26)19-6-4-5-11-23-19/h4-11H,12-16H2,1-3H3,(H,24,28)

InChI Key

PBPZYLFDOGCJFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD17582344

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.704

Distribution Coefficient, logD

3.695

Water Solubility, LogSw

-3.78

Polar Surface Area

52.816

Acid Dissociation Constant (pKa)

11.68

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

P123-0012 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with P123-0012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P123-0012?
Check Price and Availability of P123-0012, 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 P123-0012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P123-0012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P123-0012
  • 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 P123-0012 available by request