1718-0162 Screening compound: 2,5-dimethyl-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide

1718-0162 Screening compound: 2,5-dimethyl-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide
1718-0162 Screening compound: 2,5-dimethyl-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1718-0162
2,5-dimethyl-N-[(pyridin-4-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

1718-0162

Molecular Formula

C14H16N2O2S (C14 H16 N2 O2 S)

Compound Name

2,5-dimethyl-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide

IUPAC name

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

SMILES

Cc1cc(S(NCc2ccncc2)(=O)=O)c(C)cc1

InChI

InChI=1S/C14H16N2O2S/c1-11-3-4-12(2)14(9-11)19(17,18)16-10-13-5-7-15-8-6-13/h3-9,16H,10H2,1-2H3

InChI Key

BGQCREKJUBZZAE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01022165

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.36

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

2.269

Distribution Coefficient, logD

2.253

Water Solubility, LogSw

-2.47

Polar Surface Area

51.425

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

5.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

1718-0162 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Fragments Library (11262 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 1718-0162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1718-0162?
Check Price and Availability of 1718-0162, 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 1718-0162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1718-0162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1718-0162
  • 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 1718-0162 available by request