T422-0696 Screening compound: 3-{1-[6-(CYCLOPROPYLAMINO)PYRIMIDIN-4-YL]PIPERIDIN-4-YL}-1-(4-PHENYLPIPERAZIN-1-YL)PROPAN-1-ONE

T422-0696 Screening compound: 3-{1-[6-(CYCLOPROPYLAMINO)PYRIMIDIN-4-YL]PIPERIDIN-4-YL}-1-(4-PHENYLPIPERAZIN-1-YL)PROPAN-1-ONE
T422-0696 Screening compound: 3-{1-[6-(CYCLOPROPYLAMINO)PYRIMIDIN-4-YL]PIPERIDIN-4-YL}-1-(4-PHENYLPIPERAZIN-1-YL)PROPAN-1-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound T422-0696
3-{1-[6-(CYCLOPROPYLAMINO)PYRIMIDIN-4-YL]PIPERIDIN-4-YL}-1-(4-PHENYLPIPERAZIN-1-YL)PROPAN-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

T422-0696

Molecular Formula

C25H34N6O (C25 H34 N6 O)

Compound Name

3-{1-[6-(CYCLOPROPYLAMINO)PYRIMIDIN-4-YL]PIPERIDIN-4-YL}-1-(4-PHENYLPIPERAZIN-1-YL)PROPAN-1-ONE

IUPAC name

n/a

SMILES

O=C(CCC(CC1)CCN1c1ncnc(NC2CC2)c1)N(CC1)CCN1c1ccccc1

InChI

InChI=1S/C25H34N6O/c32-25(31-16-14-29(15-17-31)22-4-2-1-3-5-22)9-6-20-10-12-30(13-11-20)24-18-23(26-19-27-24)28-21-7-8-21/h1-5,18-21H,6-17H2,(H,26,27,28)

InChI Key

FLEUTGOOQZUVIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27620797

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.134

Distribution Coefficient, logD

4.133

Water Solubility, LogSw

-4.33

Polar Surface Area

53.204

Acid Dissociation Constant (pKa)

16.66

Base Dissociation Constant (pKb)

4.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

T422-0696 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

GPCR Targeted Library (31838 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

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with T422-0696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T422-0696?
Check Price and Availability of T422-0696, 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 T422-0696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T422-0696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T422-0696
  • 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 T422-0696 available by request