7547-4091 Screening compound: 5-tert-butyl-N-(5-chloropyridin-2-yl)-2-ethoxybenzene-1-sulfonamide

7547-4091 Screening compound: 5-tert-butyl-N-(5-chloropyridin-2-yl)-2-ethoxybenzene-1-sulfonamide
7547-4091 Screening compound: 5-tert-butyl-N-(5-chloropyridin-2-yl)-2-ethoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7547-4091
5-tert-butyl-N-(5-chloropyridin-2-yl)-2-ethoxybenzene-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

7547-4091

Molecular Formula

C17H21ClN2O3S (C17 H21 ClN2 O3 S)

Compound Name

5-tert-butyl-N-(5-chloropyridin-2-yl)-2-ethoxybenzene-1-sulfonamide

IUPAC name

5-tert-butyl-N-(5-chloropyridin-2-yl)-2-ethoxybenzene-1-sulfonamide

SMILES

CCOc(ccc(C(C)(C)C)c1)c1S(Nc(cc1)ncc1Cl)(=O)=O

InChI

InChI=1S/C17H21ClN2O3S/c1-5-23-14-8-6-12(17(2,3)4)10-15(14)24(21,22)20-16-9-7-13(18)11-19-16/h6-11H,5H2,1-4H3,(H,19,20)

InChI Key

AJFBXLKRQLKINN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06489773

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.88

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.797

Distribution Coefficient, logD

2.501

Water Solubility, LogSw

-4.88

Polar Surface Area

57.803

Acid Dissociation Constant (pKa)

5.11

Base Dissociation Constant (pKb)

-1.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

7547-4091 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 7547-4091 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7547-4091?
Check Price and Availability of 7547-4091, 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 7547-4091 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7547-4091
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7547-4091
  • 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 7547-4091 available by request