G508-0142 Screening compound: ethyl 2-({[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]sulfonyl}amino)benzoate

G508-0142 Screening compound: ethyl 2-({[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]sulfonyl}amino)benzoate
G508-0142 Screening compound: ethyl 2-({[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]sulfonyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G508-0142
ethyl 2-({[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]sulfonyl}amino)benzoate

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

G508-0142

Molecular Formula

C19H22N2O6S2 (C19 H22 N2 O6 S2)

Compound Name

ethyl 2-({[4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)phenyl]sulfonyl}amino)benzoate

IUPAC name

ethyl 2-[4-(11-dioxo-1lambda62-thiazinan-2-yl)benzenesulfonamido]benzoate

SMILES

CCOC(c(cccc1)c1NS(c(cc1)ccc1N(CCCC1)S1(=O)=O)(=O)=O)=O

InChI

InChI=1S/C19H22N2O6S2/c1-2-27-19(22)17-7-3-4-8-18(17)20-29(25,26)16-11-9-15(10-12-16)21-13-5-6-14-28(21,23)24/h3-4,7-12,20H,2,5-6,13-14H2,1H3

InChI Key

DWQGCQJZFWYTTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08007709

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.591

Distribution Coefficient, logD

0.954

Water Solubility, LogSw

-3.19

Polar Surface Area

92.613

Acid Dissociation Constant (pKa)

5.77

Base Dissociation Constant (pKb)

-9.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

G508-0142 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with G508-0142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G508-0142?
Check Price and Availability of G508-0142, 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 G508-0142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G508-0142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G508-0142
  • 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 G508-0142 available by request