8018-5872 Screening compound: 5-bromo-N-(2-ethoxyphenyl)-2-methoxy-4-methylbenzene-1-sulfonamide

8018-5872 Screening compound: 5-bromo-N-(2-ethoxyphenyl)-2-methoxy-4-methylbenzene-1-sulfonamide
8018-5872 Screening compound: 5-bromo-N-(2-ethoxyphenyl)-2-methoxy-4-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-5872
5-bromo-N-(2-ethoxyphenyl)-2-methoxy-4-methylbenzene-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

8018-5872

Molecular Formula

C16H18BrNO4S (C16 H18 BrNO4 S)

Compound Name

5-bromo-N-(2-ethoxyphenyl)-2-methoxy-4-methylbenzene-1-sulfonamide

IUPAC name

5-bromo-N-(2-ethoxyphenyl)-2-methoxy-4-methylbenzene-1-sulfonamide

SMILES

CCOc(cccc1)c1NS(c1cc(Br)c(C)cc1OC)(=O)=O

InChI

InChI=1S/C16H18BrNO4S/c1-4-22-14-8-6-5-7-13(14)18-23(19,20)16-10-12(17)11(2)9-15(16)21-3/h5-10,18H,4H2,1-3H3

InChI Key

YRCJOWZKCSUOFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06628970

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.29

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

4.116

Distribution Coefficient, logD

3.807

Water Solubility, LogSw

-4.27

Polar Surface Area

55.031

Acid Dissociation Constant (pKa)

7.38

Base Dissociation Constant (pKb)

-8.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8018-5872 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-5872 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-5872?
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What is the minimum amount of 8018-5872 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-5872
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-5872
  • 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 8018-5872 available by request