F261-0067 Screening compound: ethyl 4-{[3-(6-methanesulfonylpyridazin-3-yl)phenyl]sulfamoyl}benzoate

F261-0067 Screening compound: ethyl 4-{[3-(6-methanesulfonylpyridazin-3-yl)phenyl]sulfamoyl}benzoate
F261-0067 Screening compound: ethyl 4-{[3-(6-methanesulfonylpyridazin-3-yl)phenyl]sulfamoyl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound F261-0067
ethyl 4-{[3-(6-methanesulfonylpyridazin-3-yl)phenyl]sulfamoyl}benzoate

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

F261-0067

Molecular Formula

C20H19N3O6S2 (C20 H19 N3 O6 S2)

Compound Name

ethyl 4-{[3-(6-methanesulfonylpyridazin-3-yl)phenyl]sulfamoyl}benzoate

IUPAC name

ethyl 4-{[3-(6-methanesulfonylpyridazin-3-yl)phenyl]sulfamoyl}benzoate

SMILES

CCOC(c(cc1)ccc1S(Nc1cc(-c(cc2)nnc2S(C)(=O)=O)ccc1)(=O)=O)=O

InChI

InChI=1S/C20H19N3O6S2/c1-3-29-20(24)14-7-9-17(10-8-14)31(27,28)23-16-6-4-5-15(13-16)18-11-12-19(22-21-18)30(2,25)26/h4-13,23H,3H2,1-2H3

InChI Key

YRDFNLXNAZTDFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08537009

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.52

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.813

Distribution Coefficient, logD

2.809

Water Solubility, LogSw

-3.43

Polar Surface Area

112.637

Acid Dissociation Constant (pKa)

9.40

Base Dissociation Constant (pKb)

-2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F261-0067 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F261-0067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F261-0067?
Check Price and Availability of F261-0067, 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 F261-0067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F261-0067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F261-0067
  • 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 F261-0067 available by request