F046-0464 Screening compound: N-(3,4-DIFLUOROPHENYL)-2-{3-[4-(4-FLUOROPHENYL)PIPERAZIN-1-YL]-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL}ACETAMIDE

F046-0464 Screening compound: N-(3,4-DIFLUOROPHENYL)-2-{3-[4-(4-FLUOROPHENYL)PIPERAZIN-1-YL]-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL}ACETAMIDE
F046-0464 Screening compound: N-(3,4-DIFLUOROPHENYL)-2-{3-[4-(4-FLUOROPHENYL)PIPERAZIN-1-YL]-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL}ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound F046-0464
N-(3,4-DIFLUOROPHENYL)-2-{3-[4-(4-FLUOROPHENYL)PIPERAZIN-1-YL]-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL}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

F046-0464

Molecular Formula

C22H20F3N5O2 (C22 H20 F3 N5 O2)

Compound Name

N-(3,4-DIFLUOROPHENYL)-2-{3-[4-(4-FLUOROPHENYL)PIPERAZIN-1-YL]-6-OXO-1,6-DIHYDROPYRIDAZIN-1-YL}ACETAMIDE

IUPAC name

n/a

SMILES

O=C(CN(C(C=C1)=O)N=C1N(CC1)CCN1c(cc1)ccc1F)Nc(cc1)cc(F)c1F

InChI

InChI=1S/C22H20F3N5O2/c23-15-1-4-17(5-2-15)28-9-11-29(12-10-28)20-7-8-22(32)30(27-20)14-21(31)26-16-3-6-18(24)19(25)13-16/h1-8,13H,9-12,14H2,(H,26,31)

InChI Key

HDQVWEZKADUYIB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27096540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.286

Distribution Coefficient, logD

3.281

Water Solubility, LogSw

-3.41

Polar Surface Area

58.534

Acid Dissociation Constant (pKa)

9.41

Base Dissociation Constant (pKb)

5.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

F046-0464 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F046-0464 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F046-0464?
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What is the minimum amount of F046-0464 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F046-0464
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F046-0464
  • 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 F046-0464 available by request