T040-0433 Screening compound: 3-(2-morpholino-4-pyridyl)-1-[4-(2-pyridyl)piperazino]-1-propanone

T040-0433 Screening compound: 3-(2-morpholino-4-pyridyl)-1-[4-(2-pyridyl)piperazino]-1-propanone
T040-0433 Screening compound: 3-(2-morpholino-4-pyridyl)-1-[4-(2-pyridyl)piperazino]-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound T040-0433
3-(2-morpholino-4-pyridyl)-1-[4-(2-pyridyl)piperazino]-1-propanone

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

T040-0433

Molecular Formula

C21H27N5O2 (C21 H27 N5 O2)

Compound Name

3-(2-morpholino-4-pyridyl)-1-[4-(2-pyridyl)piperazino]-1-propanone

IUPAC name

3-[2-(morpholin-4-yl)pyridin-4-yl]-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-1-one

SMILES

O=C(CCc1cc(N2CCOCC2)ncc1)N(CC1)CCN1c1ncccc1

InChI

InChI=1S/C21H27N5O2/c27-21(26-11-9-24(10-12-26)19-3-1-2-7-22-19)5-4-18-6-8-23-20(17-18)25-13-15-28-16-14-25/h1-3,6-8,17H,4-5,9-16H2

InChI Key

PLZULHJSYNAFGU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.300

Distribution Coefficient, logD

2.262

Water Solubility, LogSw

-2.46

Polar Surface Area

48.003

Acid Dissociation Constant (pKa)

23.39

Base Dissociation Constant (pKb)

6.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.62

T040-0433 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

PI3K-Targeted Library (17255 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with T040-0433 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T040-0433?
Check Price and Availability of T040-0433, 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 T040-0433 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T040-0433
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T040-0433
  • 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 T040-0433 available by request