S725-0649 Screening compound: N-{4-(CYCLOPROPYLMETHYL)-1-[2-(4-FLUOROPHENOXY)ACETYL]-4-PIPERIDYL}-1-CYCLOPROPANECARBOXAMIDE

S725-0649 Screening compound: N-{4-(CYCLOPROPYLMETHYL)-1-[2-(4-FLUOROPHENOXY)ACETYL]-4-PIPERIDYL}-1-CYCLOPROPANECARBOXAMIDE
S725-0649 Screening compound: N-{4-(CYCLOPROPYLMETHYL)-1-[2-(4-FLUOROPHENOXY)ACETYL]-4-PIPERIDYL}-1-CYCLOPROPANECARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound S725-0649
N-{4-(CYCLOPROPYLMETHYL)-1-[2-(4-FLUOROPHENOXY)ACETYL]-4-PIPERIDYL}-1-CYCLOPROPANECARBOXAMIDE

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

S725-0649

Molecular Formula

C21H27FN2O3 (C21 H27 FN2 O3)

Compound Name

N-{4-(CYCLOPROPYLMETHYL)-1-[2-(4-FLUOROPHENOXY)ACETYL]-4-PIPERIDYL}-1-CYCLOPROPANECARBOXAMIDE

IUPAC name

n/a

SMILES

O=C(COc(cc1)ccc1F)N(CC1)CCC1(CC1CC1)NC(C1CC1)=O

InChI

InChI=1S/C21H27FN2O3/c22-17-5-7-18(8-6-17)27-14-19(25)24-11-9-21(10-12-24,13-15-1-2-15)23-20(26)16-3-4-16/h5-8,15-16H,1-4,9-14H2,(H,23,26)

InChI Key

YFDJGQYVCFOIHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31968553

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.440

Distribution Coefficient, logD

2.440

Water Solubility, LogSw

-2.91

Polar Surface Area

48.897

Acid Dissociation Constant (pKa)

15.15

Base Dissociation Constant (pKb)

6.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

S725-0649 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S725-0649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S725-0649?
Check Price and Availability of S725-0649, 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 S725-0649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S725-0649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S725-0649
  • 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 S725-0649 available by request