G508-0147 Screening compound: 4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-[2-(trifluoromethyl)phenyl]-1-benzenesulfonamide

G508-0147 Screening compound: 4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-[2-(trifluoromethyl)phenyl]-1-benzenesulfonamide
G508-0147 Screening compound: 4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-[2-(trifluoromethyl)phenyl]-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G508-0147
4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-[2-(trifluoromethyl)phenyl]-1-benzenesulfonamide

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

G508-0147

Molecular Formula

C17H17F3N2O4S2 (C17 H17 F3 N2 O4 S2)

Compound Name

4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-[2-(trifluoromethyl)phenyl]-1-benzenesulfonamide

IUPAC name

4-(11-dioxo-1lambda62-thiazinan-2-yl)-N-[2-(trifluoromethyl)phenyl]benzene-1-sulfonamide

SMILES

O=S(c(cc1)ccc1N(CCCC1)S1(=O)=O)(Nc1c(C(F)(F)F)cccc1)=O

InChI

InChI=1S/C17H17F3N2O4S2/c18-17(19,20)15-5-1-2-6-16(15)21-28(25,26)14-9-7-13(8-10-14)22-11-3-4-12-27(22,23)24/h1-2,5-10,21H,3-4,11-12H2

InChI Key

QEDKQJNKHCYLFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08007714

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.46

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

2.838

Distribution Coefficient, logD

2.834

Water Solubility, LogSw

-3.65

Polar Surface Area

71.860

Acid Dissociation Constant (pKa)

9.44

Base Dissociation Constant (pKb)

-9.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

G508-0147 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G508-0147 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G508-0147?
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What is the minimum amount of G508-0147 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G508-0147
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G508-0147
  • 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 G508-0147 available by request