8013-2458 Screening compound: N-(4-methoxyphenyl)-2lambda413-benzothiadiazole-4-sulfonamide

8013-2458 Screening compound: N-(4-methoxyphenyl)-2lambda413-benzothiadiazole-4-sulfonamide
8013-2458 Screening compound: N-(4-methoxyphenyl)-2lambda413-benzothiadiazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-2458
N-(4-methoxyphenyl)-2lambda413-benzothiadiazole-4-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

8013-2458

Molecular Formula

C13H11N3O3S2 (C13 H11 N3 O3 S2)

Compound Name

N-(4-methoxyphenyl)-2lambda413-benzothiadiazole-4-sulfonamide

IUPAC name

N-(4-methoxyphenyl)-2lambda413-benzothiadiazole-4-sulfonamide

SMILES

COc(cc1)ccc1NS(c1c2nsnc2ccc1)(=O)=O

InChI

InChI=1S/C13H11N3O3S2/c1-19-10-7-5-9(6-8-10)16-21(17,18)12-4-2-3-11-13(12)15-20-14-11/h2-8,16H,1H3

InChI Key

LACCHBDMJUCREJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03763954

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.657

Distribution Coefficient, logD

2.622

Water Solubility, LogSw

-3.11

Polar Surface Area

69.150

Acid Dissociation Constant (pKa)

8.48

Base Dissociation Constant (pKb)

-4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

8013-2458 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8013-2458 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-2458?
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What is the minimum amount of 8013-2458 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-2458
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-2458
  • 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 8013-2458 available by request