G508-0158 Screening compound: N~1~-(5-chloro-2-methoxyphenyl)-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-1-benzenesulfonamide

G508-0158 Screening compound: N~1~-(5-chloro-2-methoxyphenyl)-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-1-benzenesulfonamide
G508-0158 Screening compound: N~1~-(5-chloro-2-methoxyphenyl)-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G508-0158
N~1~-(5-chloro-2-methoxyphenyl)-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-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

G508-0158

Molecular Formula

C17H19ClN2O5S2 (C17 H19 ClN2 O5 S2)

Compound Name

N~1~-(5-chloro-2-methoxyphenyl)-4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-1-benzenesulfonamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-4-(11-dioxo-1lambda62-thiazinan-2-yl)benzene-1-sulfonamide

SMILES

COc(ccc(Cl)c1)c1NS(c(cc1)ccc1N(CCCC1)S1(=O)=O)(=O)=O

InChI

InChI=1S/C17H19ClN2O5S2/c1-25-17-9-4-13(18)12-16(17)19-27(23,24)15-7-5-14(6-8-15)20-10-2-3-11-26(20,21)22/h4-9,12,19H,2-3,10-11H2,1H3

InChI Key

PMLRUMPRWMYVRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08007723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.93

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.603

Distribution Coefficient, logD

1.520

Water Solubility, LogSw

-3.45

Polar Surface Area

79.490

Acid Dissociation Constant (pKa)

6.35

Base Dissociation Constant (pKb)

-9.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

G508-0158 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G508-0158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G508-0158?
Check Price and Availability of G508-0158, 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 G508-0158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G508-0158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G508-0158
  • 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 G508-0158 available by request