F616-0562 Screening compound: 4-{3-[(4-chlorophenyl)sulfanyl]-6-oxo-1,6-dihydropyridazin-1-yl}-N-[(3-methoxyphenyl)methyl]benzamide

F616-0562 Screening compound: 4-{3-[(4-chlorophenyl)sulfanyl]-6-oxo-1,6-dihydropyridazin-1-yl}-N-[(3-methoxyphenyl)methyl]benzamide
F616-0562 Screening compound: 4-{3-[(4-chlorophenyl)sulfanyl]-6-oxo-1,6-dihydropyridazin-1-yl}-N-[(3-methoxyphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F616-0562
4-{3-[(4-chlorophenyl)sulfanyl]-6-oxo-1,6-dihydropyridazin-1-yl}-N-[(3-methoxyphenyl)methyl]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

F616-0562

Molecular Formula

C25H20ClN3O3S (C25 H20 ClN3 O3 S)

Compound Name

4-{3-[(4-chlorophenyl)sulfanyl]-6-oxo-1,6-dihydropyridazin-1-yl}-N-[(3-methoxyphenyl)methyl]benzamide

IUPAC name

4-{3-[(4-chlorophenyl)sulfanyl]-6-oxo-16-dihydropyridazin-1-yl}-N-[(3-methoxyphenyl)methyl]benzamide

SMILES

COc1cccc(CNC(c(cc2)ccc2N(C(C=C2)=O)N=C2Sc(cc2)ccc2Cl)=O)c1

InChI

InChI=1S/C25H20ClN3O3S/c1-32-21-4-2-3-17(15-21)16-27-25(31)18-5-9-20(10-6-18)29-24(30)14-13-23(28-29)33-22-11-7-19(26)8-12-22/h2-15H,16H2,1H3,(H,27,31)

InChI Key

WHSAXLFUKSHCSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14961067

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.97

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.981

Distribution Coefficient, logD

4.981

Water Solubility, LogSw

-5.30

Polar Surface Area

59.505

Acid Dissociation Constant (pKa)

12.00

Base Dissociation Constant (pKb)

-1.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

References: we are preparing a list of scientific research reports with F616-0562 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F616-0562?
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What is the minimum amount of F616-0562 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F616-0562
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F616-0562
  • 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 F616-0562 available by request