8018-5902 Screening compound: 4-bromo-2,5-dimethyl-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide

8018-5902 Screening compound: 4-bromo-2,5-dimethyl-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide
8018-5902 Screening compound: 4-bromo-2,5-dimethyl-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-5902
4-bromo-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

8018-5902

Molecular Formula

C14H15BrN2O2S (C14 H15 BrN2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1cc(Br)c(C)cc1S(NCc1ccncc1)(=O)=O

InChI

InChI=1S/C14H15BrN2O2S/c1-10-8-14(11(2)7-13(10)15)20(18,19)17-9-12-3-5-16-6-4-12/h3-8,17H,9H2,1-2H3

InChI Key

OIELQPQJJUTQRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06632241

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.26

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

2.952

Distribution Coefficient, logD

2.936

Water Solubility, LogSw

-3.10

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

8018-5902 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS Targets (44014 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-5902 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-5902?
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What is the minimum amount of 8018-5902 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-5902
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-5902
  • 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 8018-5902 available by request