G498-0246 Screening compound: 2-(4-chlorophenyl)-N~1~-[5-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-2-methylphenyl]acetamide

G498-0246 Screening compound: 2-(4-chlorophenyl)-N~1~-[5-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-2-methylphenyl]acetamide
G498-0246 Screening compound: 2-(4-chlorophenyl)-N~1~-[5-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-2-methylphenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G498-0246
2-(4-chlorophenyl)-N~1~-[5-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-2-methylphenyl]acetamide

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

G498-0246

Molecular Formula

C18H19ClN2O3S (C18 H19 ClN2 O3 S)

Compound Name

2-(4-chlorophenyl)-N~1~-[5-(1,1-dioxotetrahydro-2H-1lambda~6~-isothiazol-2-yl)-2-methylphenyl]acetamide

IUPAC name

2-(4-chlorophenyl)-N-[5-(11-dioxo-1lambda62-thiazolidin-2-yl)-2-methylphenyl]acetamide

SMILES

Cc(ccc(N(CCC1)S1(=O)=O)c1)c1NC(Cc(cc1)ccc1Cl)=O

InChI

InChI=1S/C18H19ClN2O3S/c1-13-3-8-16(21-9-2-10-25(21,23)24)12-17(13)20-18(22)11-14-4-6-15(19)7-5-14/h3-8,12H,2,9-11H2,1H3,(H,20,22)

InChI Key

HTVXSYSDKJYTMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08004593

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.88

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.410

Distribution Coefficient, logD

2.410

Water Solubility, LogSw

-3.44

Polar Surface Area

54.454

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

-0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

G498-0246 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G498-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G498-0246?
Check Price and Availability of G498-0246, 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 G498-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G498-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G498-0246
  • 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 G498-0246 available by request