E959-1791 Screening compound: N-[(4-fluorophenyl)methyl]-5-(6-oxo-1,6-dihydropyridazin-3-yl)furan-2-sulfonamide

E959-1791 Screening compound: N-[(4-fluorophenyl)methyl]-5-(6-oxo-1,6-dihydropyridazin-3-yl)furan-2-sulfonamide
E959-1791 Screening compound: N-[(4-fluorophenyl)methyl]-5-(6-oxo-1,6-dihydropyridazin-3-yl)furan-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E959-1791
N-[(4-fluorophenyl)methyl]-5-(6-oxo-1,6-dihydropyridazin-3-yl)furan-2-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

E959-1791

Molecular Formula

C15H12FN3O4S (C15 H12 FN3 O4 S)

Compound Name

N-[(4-fluorophenyl)methyl]-5-(6-oxo-1,6-dihydropyridazin-3-yl)furan-2-sulfonamide

IUPAC name

N-[(4-fluorophenyl)methyl]-5-(6-oxo-16-dihydropyridazin-3-yl)furan-2-sulfonamide

SMILES

O=C(C=C1)NN=C1c(o1)ccc1S(NCc(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C15H12FN3O4S/c16-11-3-1-10(2-4-11)9-17-24(21,22)15-8-6-13(23-15)12-5-7-14(20)19-18-12/h1-8,17H,9H2,(H,19,20)

InChI Key

YHOKRNVIQRLBMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14933418

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.34

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.312

Distribution Coefficient, logD

2.311

Water Solubility, LogSw

-2.80

Polar Surface Area

88.025

Acid Dissociation Constant (pKa)

10.02

Base Dissociation Constant (pKb)

-1.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

E959-1791 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

NOTUM (Wnt signaling) Library (3881 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 E959-1791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E959-1791?
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What is the minimum amount of E959-1791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E959-1791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E959-1791
  • 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 E959-1791 available by request