Y030-1057 Screening compound: 4-methyl-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide

Y030-1057 Screening compound: 4-methyl-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide
Y030-1057 Screening compound: 4-methyl-N-[(pyridin-3-yl)methyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-1057
4-methyl-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

Y030-1057

Molecular Formula

C13H14N2O2S (C13 H14 N2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc1)ccc1S(NCc1cnccc1)(=O)=O

InChI

InChI=1S/C13H14N2O2S/c1-11-4-6-13(7-5-11)18(16,17)15-10-12-3-2-8-14-9-12/h2-9,15H,10H2,1H3

InChI Key

BHOOPQZQRVONAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00495895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.090

Distribution Coefficient, logD

2.089

Water Solubility, LogSw

-2.39

Polar Surface Area

51.515

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

3.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

Y030-1057 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
  • Fragments
Therapeutical areas:
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with Y030-1057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-1057?
Check Price and Availability of Y030-1057, 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 Y030-1057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-1057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-1057
  • 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 Y030-1057 available by request