E559-0208 Screening compound: N-(2-bromo-4-methylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide

E559-0208 Screening compound: N-(2-bromo-4-methylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide
E559-0208 Screening compound: N-(2-bromo-4-methylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E559-0208
N-(2-bromo-4-methylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide

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

E559-0208

Molecular Formula

C14H12BrN3O3S2 (C14 H12 BrN3 O3 S2)

Compound Name

N-(2-bromo-4-methylphenyl)-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonamide

IUPAC name

N-(2-bromo-4-methylphenyl)-7-methyl-5-oxo-5H-[13]thiazolo[32-a]pyrimidine-6-sulfonamide

SMILES

Cc(cc1)cc(Br)c1NS(C1=C(C)N=C2SC=CN2C1=O)(=O)=O

InChI

InChI=1S/C14H12BrN3O3S2/c1-8-3-4-11(10(15)7-8)17-23(20,21)12-9(2)16-14-18(13(12)19)5-6-22-14/h3-7,17H,1-2H3

InChI Key

VTDRNEZXVJVVCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.3

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.082

Distribution Coefficient, logD

0.580

Water Solubility, LogSw

-2.88

Polar Surface Area

65.056

Acid Dissociation Constant (pKa)

5.91

Base Dissociation Constant (pKb)

-3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

E559-0208 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Annotated Library (21441 compounds)

Purinergic Library (3321 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E559-0208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E559-0208?
Check Price and Availability of E559-0208, 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 E559-0208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E559-0208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E559-0208
  • 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 E559-0208 available by request