S233-1056 Screening compound: N-{[(7AR)-1-METHYL-2-OXOOCTAHYDRO-4AH-CYCLOPENTA[B]PYRIDIN-4-YL]METHYL}-N-METHYLPHENYLMETHANESULFONAMIDE

S233-1056 Screening compound: N-{[(7AR)-1-METHYL-2-OXOOCTAHYDRO-4AH-CYCLOPENTA[B]PYRIDIN-4-YL]METHYL}-N-METHYLPHENYLMETHANESULFONAMIDE
S233-1056 Screening compound: N-{[(7AR)-1-METHYL-2-OXOOCTAHYDRO-4AH-CYCLOPENTA[B]PYRIDIN-4-YL]METHYL}-N-METHYLPHENYLMETHANESULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound S233-1056
N-{[(7AR)-1-METHYL-2-OXOOCTAHYDRO-4AH-CYCLOPENTA[B]PYRIDIN-4-YL]METHYL}-N-METHYLPHENYLMETHANESULFONAMIDE

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

S233-1056

Molecular Formula

C18H26N2O3S (C18 H26 N2 O3 S)

Compound Name

N-{[(7AR)-1-METHYL-2-OXOOCTAHYDRO-4AH-CYCLOPENTA[B]PYRIDIN-4-YL]METHYL}-N-METHYLPHENYLMETHANESULFONAMIDE

IUPAC name

n/a

SMILES

CN(C[C@](CCC1)(CC2)[C@@H]1N(C)C2=O)S(Cc1ccccc1)(=O)=O

InChI

InChI=1S/C18H26N2O3S/c1-19(24(22,23)13-15-7-4-3-5-8-15)14-18-11-6-9-16(18)20(2)17(21)10-12-18/h3-5,7-8,16H,6,9-14H2,1-2H3/t16-,18+/m1/s1

InChI Key

ONQLYNIESKKHNE-AEFFLSMTSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.355

Distribution Coefficient, logD

1.355

Water Solubility, LogSw

-2.17

Polar Surface Area

49.026

Acid Dissociation Constant (pKa)

20.30

Base Dissociation Constant (pKb)

6.39

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.10

S233-1056 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with S233-1056 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S233-1056?
Check Price and Availability of S233-1056, 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 S233-1056 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S233-1056
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S233-1056
  • 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 S233-1056 available by request