D262-0546 Screening compound: N-(4-fluorophenyl)-2-[3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]butanamide

D262-0546 Screening compound: N-(4-fluorophenyl)-2-[3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]butanamide
D262-0546 Screening compound: N-(4-fluorophenyl)-2-[3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D262-0546
N-(4-fluorophenyl)-2-[3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]butanamide

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

D262-0546

Molecular Formula

C21H20FN3O2 (C21 H20 FN3 O2)

Compound Name

N-(4-fluorophenyl)-2-[3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]butanamide

IUPAC name

N-(4-fluorophenyl)-2-[3-(4-methylphenyl)-6-oxo-16-dihydropyridazin-1-yl]butanamide

SMILES

CCC(C(Nc(cc1)ccc1F)=O)N(C(C=C1)=O)N=C1c1ccc(C)cc1

InChI

InChI=1S/C21H20FN3O2/c1-3-19(21(27)23-17-10-8-16(22)9-11-17)25-20(26)13-12-18(24-25)15-6-4-14(2)5-7-15/h4-13,19H,3H2,1-2H3,(H,23,27)/t19-/m0/s1

InChI Key

YAZSWZFJFNFELM-IBGZPJMESA-N

MDL Number (MFCD)

MFCD11852274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.425

Distribution Coefficient, logD

4.425

Water Solubility, LogSw

-4.28

Polar Surface Area

50.028

Acid Dissociation Constant (pKa)

10.93

Base Dissociation Constant (pKb)

-0.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

D262-0546 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D262-0546 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D262-0546?
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What is the minimum amount of D262-0546 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D262-0546
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D262-0546
  • 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 D262-0546 available by request