S725-1748 Screening compound: N-[1-(4-cyanobenzoyl)-4-(cyclopropylmethyl)piperidin-4-yl]-2-methoxyacetamide

S725-1748 Screening compound: N-[1-(4-cyanobenzoyl)-4-(cyclopropylmethyl)piperidin-4-yl]-2-methoxyacetamide
S725-1748 Screening compound: N-[1-(4-cyanobenzoyl)-4-(cyclopropylmethyl)piperidin-4-yl]-2-methoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S725-1748
N-[1-(4-cyanobenzoyl)-4-(cyclopropylmethyl)piperidin-4-yl]-2-methoxyacetamide

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

S725-1748

Molecular Formula

C20H25N3O3 (C20 H25 N3 O3)

Compound Name

N-[1-(4-cyanobenzoyl)-4-(cyclopropylmethyl)piperidin-4-yl]-2-methoxyacetamide

IUPAC name

N-[1-(4-cyanobenzoyl)-4-(cyclopropylmethyl)piperidin-4-yl]-2-methoxyacetamide

SMILES

COCC(NC(CC1CC1)(CC1)CCN1C(c(cc1)ccc1C#N)=O)=O

InChI

InChI=1S/C20H25N3O3/c1-26-14-18(24)22-20(12-15-2-3-15)8-10-23(11-9-20)19(25)17-6-4-16(13-21)5-7-17/h4-7,15H,2-3,8-12,14H2,1H3,(H,22,24)

InChI Key

WRHIQWIFFDOIAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31994802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.423

Distribution Coefficient, logD

1.423

Water Solubility, LogSw

-2.02

Polar Surface Area

66.940

Acid Dissociation Constant (pKa)

15.21

Base Dissociation Constant (pKb)

4.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

S725-1748 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Receptor's ligands
Structure:
  • Mimetics
Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors

References: we are preparing a list of scientific research reports with S725-1748 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S725-1748?
Check Price and Availability of S725-1748, 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 S725-1748 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S725-1748
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S725-1748
  • 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 S725-1748 available by request