G845-0139 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-N-methylacetamide

G845-0139 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-N-methylacetamide
G845-0139 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G845-0139
2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-N-methylacetamide

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

G845-0139

Molecular Formula

C14H13N3O4S2 (C14 H13 N3 O4 S2)

Compound Name

2-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-N-methylacetamide

IUPAC name

2-(213-benzothiadiazole-4-sulfonyl)-N-[(furan-2-yl)methyl]-N-methylacetamide

SMILES

CN(Cc1ccco1)C(CS(c1cccc2nsnc12)(=O)=O)=O

InChI

InChI=1S/C14H13N3O4S2/c1-17(8-10-4-3-7-21-10)13(18)9-23(19,20)12-6-2-5-11-14(12)16-22-15-11/h2-7H,8-9H2,1H3

InChI Key

AGTUWPUAKHRGQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15039848

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.756

Distribution Coefficient, logD

1.756

Water Solubility, LogSw

-2.28

Polar Surface Area

73.599

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

-2.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

G845-0139 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G845-0139 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G845-0139?
Check Price and Availability of G845-0139, 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 G845-0139 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G845-0139
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G845-0139
  • 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 G845-0139 available by request