S725-1852 Screening compound: N-{1-[2-(benzyloxy)acetyl]-4-(cyclopropylmethyl)piperidin-4-yl}-2-methoxyacetamide

S725-1852 Screening compound: N-{1-[2-(benzyloxy)acetyl]-4-(cyclopropylmethyl)piperidin-4-yl}-2-methoxyacetamide
S725-1852 Screening compound: N-{1-[2-(benzyloxy)acetyl]-4-(cyclopropylmethyl)piperidin-4-yl}-2-methoxyacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S725-1852
N-{1-[2-(benzyloxy)acetyl]-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

S725-1852

Molecular Formula

C21H30N2O4 (C21 H30 N2 O4)

Compound Name

N-{1-[2-(benzyloxy)acetyl]-4-(cyclopropylmethyl)piperidin-4-yl}-2-methoxyacetamide

IUPAC name

N-{1-[2-(benzyloxy)acetyl]-4-(cyclopropylmethyl)piperidin-4-yl}-2-methoxyacetamide

SMILES

COCC(NC(CC1CC1)(CC1)CCN1C(COCc1ccccc1)=O)=O

InChI

InChI=1S/C21H30N2O4/c1-26-15-19(24)22-21(13-17-7-8-17)9-11-23(12-10-21)20(25)16-27-14-18-5-3-2-4-6-18/h2-6,17H,7-16H2,1H3,(H,22,24)

InChI Key

QDYUFYSKRJZWOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31995056

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.597

Distribution Coefficient, logD

1.597

Water Solubility, LogSw

-1.88

Polar Surface Area

57.791

Acid Dissociation Constant (pKa)

15.21

Base Dissociation Constant (pKb)

4.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.90

S725-1852 in Drug Discovery

Included in Screening Libraries

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 S725-1852 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S725-1852?
Check Price and Availability of S725-1852, 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 S725-1852 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S725-1852
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S725-1852
  • 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 S725-1852 available by request