S720-0192 Screening compound: 4-[1-(oxan-4-yl)-4-phenoxypyrrolidine-2-carbonyl]morpholine

S720-0192 Screening compound: 4-[1-(oxan-4-yl)-4-phenoxypyrrolidine-2-carbonyl]morpholine
S720-0192 Screening compound: 4-[1-(oxan-4-yl)-4-phenoxypyrrolidine-2-carbonyl]morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound S720-0192
4-[1-(oxan-4-yl)-4-phenoxypyrrolidine-2-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

S720-0192

Molecular Formula

C20H28N2O4 (C20 H28 N2 O4)

Compound Name

4-[1-(oxan-4-yl)-4-phenoxypyrrolidine-2-carbonyl]morpholine

IUPAC name

4-[(2S4S)-1-(oxan-4-yl)-4-phenoxypyrrolidine-2-carbonyl]morpholine

SMILES

O=C([C@H](C[C@@H](C1)Oc2ccccc2)N1C1CCOCC1)N1CCOCC1

InChI

InChI=1S/C20H28N2O4/c23-20(21-8-12-25-13-9-21)19-14-18(26-17-4-2-1-3-5-17)15-22(19)16-6-10-24-11-7-16/h1-5,16,18-19H,6-15H2/t18-,19+/m1/s1

InChI Key

GCOVWCYHOSKZIA-MOPGFXCFSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.621

Distribution Coefficient, logD

1.619

Water Solubility, LogSw

-1.73

Polar Surface Area

42.244

Acid Dissociation Constant (pKa)

21.83

Base Dissociation Constant (pKb)

5.14

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

65.00

S720-0192 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 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 S720-0192 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S720-0192?
Check Price and Availability of S720-0192, 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 S720-0192 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S720-0192
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S720-0192
  • 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 S720-0192 available by request