S065-0034 Screening compound: N-{1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl}-2-(3-fluorophenyl)acetamide

S065-0034 Screening compound: N-{1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl}-2-(3-fluorophenyl)acetamide
S065-0034 Screening compound: N-{1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl}-2-(3-fluorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S065-0034
N-{1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl}-2-(3-fluorophenyl)acetamide

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

S065-0034

Molecular Formula

C19H24FN5O (C19 H24 FN5 O)

Compound Name

N-{1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl}-2-(3-fluorophenyl)acetamide

IUPAC name

N-{1-[6-(dimethylamino)pyrimidin-4-yl]piperidin-3-yl}-2-(3-fluorophenyl)acetamide

SMILES

CN(C)c1cc(N(CCC2)CC2NC(Cc2cccc(F)c2)=O)ncn1

InChI

InChI=1S/C19H24FN5O/c1-24(2)17-11-18(22-13-21-17)25-8-4-7-16(12-25)23-19(26)10-14-5-3-6-15(20)9-14/h3,5-6,9,11,13,16H,4,7-8,10,12H2,1-2H3,(H,23,26)/t16-/m0/s1

InChI Key

PRGWGOCIAVZYIW-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27617476

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.956

Distribution Coefficient, logD

2.883

Water Solubility, LogSw

-3.27

Polar Surface Area

48.899

Acid Dissociation Constant (pKa)

14.39

Base Dissociation Constant (pKb)

6.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.10

S065-0034 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 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)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S065-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S065-0034?
Check Price and Availability of S065-0034, 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 S065-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S065-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S065-0034
  • 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 S065-0034 available by request