E823-0121 Screening compound: 1-morpholino-3-(3-{[4-(propylsulfonyl)piperazino]methyl}-1,2,4-oxadiazol-5-yl)-1-propanone

E823-0121 Screening compound: 1-morpholino-3-(3-{[4-(propylsulfonyl)piperazino]methyl}-1,2,4-oxadiazol-5-yl)-1-propanone
E823-0121 Screening compound: 1-morpholino-3-(3-{[4-(propylsulfonyl)piperazino]methyl}-1,2,4-oxadiazol-5-yl)-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound E823-0121
1-morpholino-3-(3-{[4-(propylsulfonyl)piperazino]methyl}-1,2,4-oxadiazol-5-yl)-1-propanone

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

E823-0121

Molecular Formula

C17H29N5O5S (C17 H29 N5 O5 S)

Compound Name

1-morpholino-3-(3-{[4-(propylsulfonyl)piperazino]methyl}-1,2,4-oxadiazol-5-yl)-1-propanone

IUPAC name

n/a

SMILES

CCCS(N1CCN(Cc2noc(CCC(N3CCOCC3)=O)n2)CC1)(=O)=O

InChI

InChI=1S/C17H29N5O5S/c1-2-13-28(24,25)22-7-5-20(6-8-22)14-15-18-16(27-19-15)3-4-17(23)21-9-11-26-12-10-21/h2-14H2,1H3

InChI Key

VICBDXUKXILCPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14920499

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

415.51

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.634

Distribution Coefficient, logD

-0.634

Water Solubility, LogSw

-0.90

Polar Surface Area

92.290

Acid Dissociation Constant (pKa)

22.48

Base Dissociation Constant (pKb)

4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

82.40

E823-0121 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E823-0121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E823-0121?
Check Price and Availability of E823-0121, 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 E823-0121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E823-0121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E823-0121
  • 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 E823-0121 available by request