S724-0916 Screening compound: 4-[1-(1-phenylmethanesulfonylazetidin-3-yl)-1H-1,2,3-triazole-4-carbonyl]morpholine

S724-0916 Screening compound: 4-[1-(1-phenylmethanesulfonylazetidin-3-yl)-1H-1,2,3-triazole-4-carbonyl]morpholine
S724-0916 Screening compound: 4-[1-(1-phenylmethanesulfonylazetidin-3-yl)-1H-1,2,3-triazole-4-carbonyl]morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound S724-0916
4-[1-(1-phenylmethanesulfonylazetidin-3-yl)-1H-1,2,3-triazole-4-carbonyl]morpholine

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

S724-0916

Molecular Formula

C17H21N5O4S (C17 H21 N5 O4 S)

Compound Name

4-[1-(1-phenylmethanesulfonylazetidin-3-yl)-1H-1,2,3-triazole-4-carbonyl]morpholine

IUPAC name

4-[1-(1-phenylmethanesulfonylazetidin-3-yl)-1H-123-triazole-4-carbonyl]morpholine

SMILES

O=C(c1cn(C(C2)CN2S(Cc2ccccc2)(=O)=O)nn1)N1CCOCC1

InChI

InChI=1S/C17H21N5O4S/c23-17(20-6-8-26-9-7-20)16-12-22(19-18-16)15-10-21(11-15)27(24,25)13-14-4-2-1-3-5-14/h1-5,12,15H,6-11,13H2

InChI Key

HROXYKBBBIVZOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31987196

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.256

Distribution Coefficient, logD

-0.256

Water Solubility, LogSw

-1.65

Polar Surface Area

82.605

Acid Dissociation Constant (pKa)

20.30

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.06

S724-0916 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S724-0916 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S724-0916?
Check Price and Availability of S724-0916, 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 S724-0916 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S724-0916
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S724-0916
  • 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 S724-0916 available by request