S722-1327 Screening compound: [(4-{[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]methyl}phenyl)methyl](2-methoxyethyl)methylamine

S722-1327 Screening compound: [(4-{[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]methyl}phenyl)methyl](2-methoxyethyl)methylamine
S722-1327 Screening compound: [(4-{[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]methyl}phenyl)methyl](2-methoxyethyl)methylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound S722-1327
[(4-{[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]methyl}phenyl)methyl](2-methoxyethyl)methylamine

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

S722-1327

Molecular Formula

C23H34N4O2 (C23 H34 N4 O2)

Compound Name

[(4-{[1-(1,5-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]methyl}phenyl)methyl](2-methoxyethyl)methylamine

IUPAC name

[(4-{[1-(15-dimethyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]methyl}phenyl)methyl](2-methoxyethyl)methylamine

SMILES

Cc1cc(C(N2CCC(Cc3ccc(CN(C)CCOC)cc3)CC2)=O)nn1C

InChI

InChI=1S/C23H34N4O2/c1-18-15-22(24-26(18)3)23(28)27-11-9-20(10-12-27)16-19-5-7-21(8-6-19)17-25(2)13-14-29-4/h5-8,15,20H,9-14,16-17H2,1-4H3

InChI Key

GJVQICHNCGKLMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31986059

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.246

Distribution Coefficient, logD

1.045

Water Solubility, LogSw

-2.59

Polar Surface Area

43.538

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

8.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.52

S722-1327 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 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 S722-1327 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S722-1327?
Check Price and Availability of S722-1327, 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 S722-1327 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S722-1327
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S722-1327
  • 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 S722-1327 available by request