S766-0988 Screening compound: N~3~-[(1R)-1-benzyl-2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-3-furamide

S766-0988 Screening compound: N~3~-[(1R)-1-benzyl-2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-3-furamide
S766-0988 Screening compound: N~3~-[(1R)-1-benzyl-2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-3-furamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S766-0988
N~3~-[(1R)-1-benzyl-2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-3-furamide

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

S766-0988

Molecular Formula

C21H25N3O5 (C21 H25 N3 O5)

Compound Name

N~3~-[(1R)-1-benzyl-2-oxo-2-(7-oxo-1,4,8-oxadiazecan-4-yl)ethyl]-3-furamide

IUPAC name

n/a

SMILES

O=C([C@@H](Cc1ccccc1)NC(c1cocc1)=O)N(CC1)CCOCCNC1=O

InChI

InChI=1S/C21H25N3O5/c25-19-6-9-24(10-13-28-12-8-22-19)21(27)18(14-16-4-2-1-3-5-16)23-20(26)17-7-11-29-15-17/h1-5,7,11,15,18H,6,8-10,12-14H2,(H,22,25)(H,23,26)/t18-/m1/s1

InChI Key

OOVGQJJPMIGTSN-GOSISDBHSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.416

Distribution Coefficient, logD

0.416

Water Solubility, LogSw

-1.64

Polar Surface Area

81.997

Acid Dissociation Constant (pKa)

12.01

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

S766-0988 in Drug Discovery

Included in Screening Libraries

Macrocycles Library (2450 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S766-0988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S766-0988?
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What is the minimum amount of S766-0988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S766-0988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S766-0988
  • 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 S766-0988 available by request