F261-0063 Screening compound: N-[3-(6-methanesulfonylpyridazin-3-yl)phenyl]-4-(trifluoromethoxy)benzene-1-sulfonamide

F261-0063 Screening compound: N-[3-(6-methanesulfonylpyridazin-3-yl)phenyl]-4-(trifluoromethoxy)benzene-1-sulfonamide
F261-0063 Screening compound: N-[3-(6-methanesulfonylpyridazin-3-yl)phenyl]-4-(trifluoromethoxy)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F261-0063
N-[3-(6-methanesulfonylpyridazin-3-yl)phenyl]-4-(trifluoromethoxy)benzene-1-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

F261-0063

Molecular Formula

C18H14F3N3O5S2 (C18 H14 F3 N3 O5 S2)

Compound Name

N-[3-(6-methanesulfonylpyridazin-3-yl)phenyl]-4-(trifluoromethoxy)benzene-1-sulfonamide

IUPAC name

N-[3-(6-methanesulfonylpyridazin-3-yl)phenyl]-4-(trifluoromethoxy)benzene-1-sulfonamide

SMILES

CS(c(cc1)nnc1-c1cccc(NS(c(cc2)ccc2OC(F)(F)F)(=O)=O)c1)(=O)=O

InChI

InChI=1S/C18H14F3N3O5S2/c1-30(25,26)17-10-9-16(22-23-17)12-3-2-4-13(11-12)24-31(27,28)15-7-5-14(6-8-15)29-18(19,20)21/h2-11,24H,1H3

InChI Key

JNEUAQCXYXVKBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08537005

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.45

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.403

Distribution Coefficient, logD

3.403

Water Solubility, LogSw

-3.96

Polar Surface Area

97.820

Acid Dissociation Constant (pKa)

10.41

Base Dissociation Constant (pKb)

-2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

F261-0063 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with F261-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F261-0063?
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What is the minimum amount of F261-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F261-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F261-0063
  • 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 F261-0063 available by request