G857-0270 Screening compound: ethyl 2-[(7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate

G857-0270 Screening compound: ethyl 2-[(7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate
G857-0270 Screening compound: ethyl 2-[(7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound G857-0270
ethyl 2-[(7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate

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

G857-0270

Molecular Formula

C11H11FN2O4S2 (C11 H11 FN2 O4 S2)

Compound Name

ethyl 2-[(7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetate

IUPAC name

ethyl 2-[(7-fluoro-11-dioxo-4H-1lambda624-benzothiadiazin-3-yl)sulfanyl]acetate

SMILES

CCOC(CSC(Nc(cc1)c2cc1F)=NS2(=O)=O)=O

InChI

InChI=1S/C11H11FN2O4S2/c1-2-18-10(15)6-19-11-13-8-4-3-7(12)5-9(8)20(16,17)14-11/h3-5H,2,6H2,1H3,(H,13,14)

InChI Key

QKAHSMDZCDRQNW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07196694

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.622

Distribution Coefficient, logD

0.636

Water Solubility, LogSw

-2.67

Polar Surface Area

73.136

Acid Dissociation Constant (pKa)

6.46

Base Dissociation Constant (pKb)

0.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G857-0270 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G857-0270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G857-0270?
Check Price and Availability of G857-0270, 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 G857-0270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G857-0270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G857-0270
  • 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 G857-0270 available by request