1786-0043 Screening compound: 4-propoxy-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide

1786-0043 Screening compound: 4-propoxy-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide
1786-0043 Screening compound: 4-propoxy-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1786-0043
4-propoxy-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide

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

1786-0043

Molecular Formula

C15H18N2O3S (C15 H18 N2 O3 S)

Compound Name

4-propoxy-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide

IUPAC name

4-propoxy-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide

SMILES

CCCOc(cc1)ccc1S(NCc1cnccc1)(=O)=O

InChI

InChI=1S/C15H18N2O3S/c1-2-10-20-14-5-7-15(8-6-14)21(18,19)17-12-13-4-3-9-16-11-13/h3-9,11,17H,2,10,12H2,1H3

InChI Key

DUHMDAQYKZDFIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01360976

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.626

Distribution Coefficient, logD

2.625

Water Solubility, LogSw

-2.57

Polar Surface Area

58.932

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

3.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

1786-0043 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 1786-0043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1786-0043?
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What is the minimum amount of 1786-0043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1786-0043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1786-0043
  • 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 1786-0043 available by request