S766-1144 Screening compound: 1-[1-oxo-1-(7-oxo-1,4,8-oxadiazecan-4-yl)-3-phenylpropan-2-yl]-3-(2-phenylethyl)urea

S766-1144 Screening compound: 1-[1-oxo-1-(7-oxo-1,4,8-oxadiazecan-4-yl)-3-phenylpropan-2-yl]-3-(2-phenylethyl)urea
S766-1144 Screening compound: 1-[1-oxo-1-(7-oxo-1,4,8-oxadiazecan-4-yl)-3-phenylpropan-2-yl]-3-(2-phenylethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound S766-1144
1-[1-oxo-1-(7-oxo-1,4,8-oxadiazecan-4-yl)-3-phenylpropan-2-yl]-3-(2-phenylethyl)urea

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

S766-1144

Molecular Formula

C25H32N4O4 (C25 H32 N4 O4)

Compound Name

1-[1-oxo-1-(7-oxo-1,4,8-oxadiazecan-4-yl)-3-phenylpropan-2-yl]-3-(2-phenylethyl)urea

IUPAC name

1-[(2R)-1-oxo-1-(7-oxo-148-oxadiazecan-4-yl)-3-phenylpropan-2-yl]-3-(2-phenylethyl)urea

SMILES

O=C([C@@H](Cc1ccccc1)NC(NCCc1ccccc1)=O)N(CC1)CCOCCNC1=O

InChI

InChI=1S/C25H32N4O4/c30-23-12-15-29(16-18-33-17-14-26-23)24(31)22(19-21-9-5-2-6-10-21)28-25(32)27-13-11-20-7-3-1-4-8-20/h1-10,22H,11-19H2,(H,26,30)(H2,27,28,32)/t22-/m1/s1

InChI Key

XYSJWPKKSXEIPQ-JOCHJYFZSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.897

Distribution Coefficient, logD

0.897

Water Solubility, LogSw

-1.69

Polar Surface Area

84.569

Acid Dissociation Constant (pKa)

13.17

Base Dissociation Constant (pKb)

0.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

S766-1144 in Drug Discovery

Included in Screening Libraries

Macrocycles Library (2450 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S766-1144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S766-1144?
Check Price and Availability of S766-1144, 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 S766-1144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S766-1144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S766-1144
  • 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 S766-1144 available by request