T428-0762 Screening compound: 1-[4-(3-methoxyphenyl)piperazino]-2-{1-[2-(methylamino)-4-pyrimidinyl]-4-piperidyl}-1-ethanone

T428-0762 Screening compound: 1-[4-(3-methoxyphenyl)piperazino]-2-{1-[2-(methylamino)-4-pyrimidinyl]-4-piperidyl}-1-ethanone
T428-0762 Screening compound: 1-[4-(3-methoxyphenyl)piperazino]-2-{1-[2-(methylamino)-4-pyrimidinyl]-4-piperidyl}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound T428-0762
1-[4-(3-methoxyphenyl)piperazino]-2-{1-[2-(methylamino)-4-pyrimidinyl]-4-piperidyl}-1-ethanone

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

T428-0762

Molecular Formula

C23H32N6O2 (C23 H32 N6 O2)

Compound Name

1-[4-(3-methoxyphenyl)piperazino]-2-{1-[2-(methylamino)-4-pyrimidinyl]-4-piperidyl}-1-ethanone

IUPAC name

n/a

SMILES

CNc1nccc(N2CCC(CC(N(CC3)CCN3c3cc(OC)ccc3)=O)CC2)n1

InChI

InChI=1S/C23H32N6O2/c1-24-23-25-9-6-21(26-23)28-10-7-18(8-11-28)16-22(30)29-14-12-27(13-15-29)19-4-3-5-20(17-19)31-2/h3-6,9,17-18H,7-8,10-16H2,1-2H3,(H,24,25,26)

InChI Key

PBEYXSARRNSEMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27621255

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.160

Distribution Coefficient, logD

3.148

Water Solubility, LogSw

-3.25

Polar Surface Area

60.873

Acid Dissociation Constant (pKa)

18.66

Base Dissociation Constant (pKb)

5.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.20

T428-0762 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with T428-0762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T428-0762?
Check Price and Availability of T428-0762, 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 T428-0762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T428-0762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T428-0762
  • 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 T428-0762 available by request