G845-0127 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylacetamide

G845-0127 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylacetamide
G845-0127 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G845-0127
2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylacetamide

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

G845-0127

Molecular Formula

C14H11N3O3S2 (C14 H11 N3 O3 S2)

Compound Name

2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-phenylacetamide

IUPAC name

2-(213-benzothiadiazole-4-sulfonyl)-N-phenylacetamide

SMILES

O=C(CS(c1cccc2nsnc12)(=O)=O)Nc1ccccc1

InChI

InChI=1S/C14H11N3O3S2/c18-13(15-10-5-2-1-3-6-10)9-22(19,20)12-8-4-7-11-14(12)17-21-16-11/h1-8H,9H2,(H,15,18)

InChI Key

NWRJPYZITNULMC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15039844

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.190

Distribution Coefficient, logD

2.190

Water Solubility, LogSw

-2.62

Polar Surface Area

73.105

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

G845-0127 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G845-0127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G845-0127?
Check Price and Availability of G845-0127, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G845-0127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G845-0127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G845-0127
  • 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 G845-0127 available by request