6113-2314 Screening compound: 3-bromo-4-methoxy-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide

6113-2314 Screening compound: 3-bromo-4-methoxy-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide
6113-2314 Screening compound: 3-bromo-4-methoxy-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6113-2314
3-bromo-4-methoxy-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

6113-2314

Molecular Formula

C13H13BrN2O3S (C13 H13 BrN2 O3 S)

Compound Name

3-bromo-4-methoxy-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide

IUPAC name

3-bromo-4-methoxy-N-[(pyridin-4-yl)methyl]benzene-1-sulfonamide

SMILES

COc(ccc(S(NCc1ccncc1)(=O)=O)c1)c1Br

InChI

InChI=1S/C13H13BrN2O3S/c1-19-13-3-2-11(8-12(13)14)20(17,18)16-9-10-4-6-15-7-5-10/h2-8,16H,9H2,1H3

InChI Key

IGFKRCLCAPBRPQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02136953

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.23

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.050

Distribution Coefficient, logD

2.039

Water Solubility, LogSw

-2.53

Polar Surface Area

59.055

Acid Dissociation Constant (pKa)

9.96

Base Dissociation Constant (pKb)

5.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

6113-2314 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

CNS Targets (44014 compounds)

Akt-Targeted Library (14764 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with 6113-2314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6113-2314?
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What is the minimum amount of 6113-2314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6113-2314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6113-2314
  • 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 6113-2314 available by request