8014-9939 Screening compound: 4-tert-butyl-N-[2-(pyridin-4-yl)ethyl]benzene-1-sulfonamide

8014-9939 Screening compound: 4-tert-butyl-N-[2-(pyridin-4-yl)ethyl]benzene-1-sulfonamide
8014-9939 Screening compound: 4-tert-butyl-N-[2-(pyridin-4-yl)ethyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-9939
4-tert-butyl-N-[2-(pyridin-4-yl)ethyl]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

8014-9939

Molecular Formula

C17H22N2O2S (C17 H22 N2 O2 S)

Compound Name

4-tert-butyl-N-[2-(pyridin-4-yl)ethyl]benzene-1-sulfonamide

IUPAC name

4-tert-butyl-N-[2-(pyridin-4-yl)ethyl]benzene-1-sulfonamide

SMILES

CC(C)(C)c(cc1)ccc1S(NCCc1ccncc1)(=O)=O

InChI

InChI=1S/C17H22N2O2S/c1-17(2,3)15-4-6-16(7-5-15)22(20,21)19-13-10-14-8-11-18-12-9-14/h4-9,11-12,19H,10,13H2,1-3H3

InChI Key

NGBKQJUYUFFZGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03821508

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.498

Distribution Coefficient, logD

3.482

Water Solubility, LogSw

-3.68

Polar Surface Area

51.266

Acid Dissociation Constant (pKa)

11.79

Base Dissociation Constant (pKb)

5.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

8014-9939 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8014-9939 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-9939?
Check Price and Availability of 8014-9939, 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 8014-9939 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-9939
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-9939
  • 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 8014-9939 available by request