5596-0098 Screening compound: 2,6-dimethoxy-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide

5596-0098 Screening compound: 2,6-dimethoxy-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide
5596-0098 Screening compound: 2,6-dimethoxy-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5596-0098
2,6-dimethoxy-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide

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

5596-0098

Molecular Formula

C18H17N3O5S2 (C18 H17 N3 O5 S2)

Compound Name

2,6-dimethoxy-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}benzamide

IUPAC name

26-dimethoxy-N-{4-[(13-thiazol-2-yl)sulfamoyl]phenyl}benzamide

SMILES

COc1cccc(OC)c1C(Nc(cc1)ccc1S(Nc1nccs1)(=O)=O)=O

InChI

InChI=1S/C18H17N3O5S2/c1-25-14-4-3-5-15(26-2)16(14)17(22)20-12-6-8-13(9-7-12)28(23,24)21-18-19-10-11-27-18/h3-11H,1-2H3,(H,19,21)(H,20,22)

InChI Key

WKNJAZJJVACSOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01358507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.233

Distribution Coefficient, logD

1.419

Water Solubility, LogSw

-3.03

Polar Surface Area

89.719

Acid Dissociation Constant (pKa)

6.66

Base Dissociation Constant (pKb)

0.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

5596-0098 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Targeted Diversity Library (40567 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 5596-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5596-0098?
Check Price and Availability of 5596-0098, 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 5596-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5596-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5596-0098
  • 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 5596-0098 available by request