F809-0112 Screening compound: 2-[3-(4-chlorobenzenesulfonyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide

F809-0112 Screening compound: 2-[3-(4-chlorobenzenesulfonyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide
F809-0112 Screening compound: 2-[3-(4-chlorobenzenesulfonyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F809-0112
2-[3-(4-chlorobenzenesulfonyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethoxyphenyl)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

F809-0112

Molecular Formula

C20H18ClN3O6S (C20 H18 ClN3 O6 S)

Compound Name

2-[3-(4-chlorobenzenesulfonyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide

IUPAC name

2-[3-(4-chlorobenzenesulfonyl)-6-oxo-16-dihydropyridazin-1-yl]-N-(35-dimethoxyphenyl)acetamide

SMILES

COc1cc(NC(CN(C(C=C2)=O)N=C2S(c(cc2)ccc2Cl)(=O)=O)=O)cc(OC)c1

InChI

InChI=1S/C20H18ClN3O6S/c1-29-15-9-14(10-16(11-15)30-2)22-18(25)12-24-20(26)8-7-19(23-24)31(27,28)17-5-3-13(21)4-6-17/h3-11H,12H2,1-2H3,(H,22,25)

InChI Key

PJWYRCHECDSZJL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27192597

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.9

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.924

Distribution Coefficient, logD

2.924

Water Solubility, LogSw

-3.54

Polar Surface Area

96.340

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

-0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F809-0112 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F809-0112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F809-0112?
Check Price and Availability of F809-0112, 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 F809-0112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F809-0112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F809-0112
  • 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 F809-0112 available by request