SA87-0144 Screening compound: 3-(benzenesulfonyl)-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}propanamide

SA87-0144 Screening compound: 3-(benzenesulfonyl)-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}propanamide
SA87-0144 Screening compound: 3-(benzenesulfonyl)-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA87-0144
3-(benzenesulfonyl)-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}propanamide

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

SA87-0144

Molecular Formula

C18H26N2O5S (C18 H26 N2 O5 S)

Compound Name

3-(benzenesulfonyl)-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}propanamide

IUPAC name

3-(benzenesulfonyl)-N-{[4-(2-methylpropyl)-5-oxomorpholin-2-yl]methyl}propanamide

SMILES

CC(C)CN(CC(CNC(CCS(c1ccccc1)(=O)=O)=O)OC1)C1=O

InChI

InChI=1S/C18H26N2O5S/c1-14(2)11-20-12-15(25-13-18(20)22)10-19-17(21)8-9-26(23,24)16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3,(H,19,21)/t15-/m0/s1

InChI Key

ILWMYOALJKYGJY-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD32242778

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.158

Distribution Coefficient, logD

0.158

Water Solubility, LogSw

-2.19

Polar Surface Area

79.170

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

-0.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

SA87-0144 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

CNS MPO Library (28609 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with SA87-0144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA87-0144?
Check Price and Availability of SA87-0144, 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 SA87-0144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA87-0144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA87-0144
  • 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 SA87-0144 available by request