8018-5863 Screening compound: N-(4-acetylphenyl)-4-bromo-3-ethoxybenzene-1-sulfonamide

8018-5863 Screening compound: N-(4-acetylphenyl)-4-bromo-3-ethoxybenzene-1-sulfonamide
8018-5863 Screening compound: N-(4-acetylphenyl)-4-bromo-3-ethoxybenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-5863
N-(4-acetylphenyl)-4-bromo-3-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

8018-5863

Molecular Formula

C16H16BrNO4S (C16 H16 BrNO4 S)

Compound Name

N-(4-acetylphenyl)-4-bromo-3-ethoxybenzene-1-sulfonamide

IUPAC name

N-(4-acetylphenyl)-4-bromo-3-ethoxybenzene-1-sulfonamide

SMILES

CCOc(cc(cc1)S(Nc(cc2)ccc2C(C)=O)(=O)=O)c1Br

InChI

InChI=1S/C16H16BrNO4S/c1-3-22-16-10-14(8-9-15(16)17)23(20,21)18-13-6-4-12(5-7-13)11(2)19/h4-10,18H,3H2,1-2H3

InChI Key

FBIBQNBZJUKNOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06008069

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.28

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.449

Distribution Coefficient, logD

2.750

Water Solubility, LogSw

-3.66

Polar Surface Area

61.925

Acid Dissociation Constant (pKa)

6.80

Base Dissociation Constant (pKb)

-11.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8018-5863 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8018-5863 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-5863?
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What is the minimum amount of 8018-5863 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-5863
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-5863
  • 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 8018-5863 available by request