S035-1297 Screening compound: N-{(1S,4S,5S)-2-[(6-methyl-3-pyridyl)carbonyl]-2-azabicyclo[2.2.1]hept-5-yl}-2-thiophenesulfonamide

S035-1297 Screening compound: N-{(1S,4S,5S)-2-[(6-methyl-3-pyridyl)carbonyl]-2-azabicyclo[2.2.1]hept-5-yl}-2-thiophenesulfonamide
S035-1297 Screening compound: N-{(1S,4S,5S)-2-[(6-methyl-3-pyridyl)carbonyl]-2-azabicyclo[2.2.1]hept-5-yl}-2-thiophenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S035-1297
N-{(1S,4S,5S)-2-[(6-methyl-3-pyridyl)carbonyl]-2-azabicyclo[2.2.1]hept-5-yl}-2-thiophenesulfonamide

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

S035-1297

Molecular Formula

C17H19N3O3S2 (C17 H19 N3 O3 S2)

Compound Name

N-{(1S,4S,5S)-2-[(6-methyl-3-pyridyl)carbonyl]-2-azabicyclo[2.2.1]hept-5-yl}-2-thiophenesulfonamide

IUPAC name

N-[(1S4S5S)-2-(6-methylpyridine-3-carbonyl)-2-azabicyclo[2.2.1]heptan-5-yl]thiophene-2-sulfonamide

SMILES

Cc(cc1)ncc1C(N(C[C@@H]1C2)[C@@H]2C[C@@H]1NS(c1cccs1)(=O)=O)=O

InChI

InChI=1S/C17H19N3O3S2/c1-11-4-5-12(9-18-11)17(21)20-10-13-7-14(20)8-15(13)19-25(22,23)16-3-2-6-24-16/h2-6,9,13-15,19H,7-8,10H2,1H3/t13-,14-,15-/m0/s1

InChI Key

DBFPBFISEDWCAM-KKUMJFAQSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.737

Distribution Coefficient, logD

1.737

Water Solubility, LogSw

-2.38

Polar Surface Area

68.796

Acid Dissociation Constant (pKa)

10.84

Base Dissociation Constant (pKb)

3.86

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

41.18

S035-1297 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 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:
  • Cyclic compounds
  • Cyclic compounds
Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with S035-1297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S035-1297?
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What is the minimum amount of S035-1297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S035-1297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S035-1297
  • 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 S035-1297 available by request