Y041-4970 Screening compound: 2-[3-(2-fluorophenyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(4-phenylbutan-2-yl)acetamide

Y041-4970 Screening compound: 2-[3-(2-fluorophenyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(4-phenylbutan-2-yl)acetamide
Y041-4970 Screening compound: 2-[3-(2-fluorophenyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(4-phenylbutan-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-4970
2-[3-(2-fluorophenyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(4-phenylbutan-2-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

Y041-4970

Molecular Formula

C22H22FN3O2 (C22 H22 FN3 O2)

Compound Name

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

IUPAC name

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

SMILES

CC(CCc1ccccc1)NC(CN(C(C=C1)=O)N=C1c(cccc1)c1F)=O

InChI

InChI=1S/C22H22FN3O2/c1-16(11-12-17-7-3-2-4-8-17)24-21(27)15-26-22(28)14-13-20(25-26)18-9-5-6-10-19(18)23/h2-10,13-14,16H,11-12,15H2,1H3,(H,24,27)/t16-/m0/s1

InChI Key

LQWTWMYRRFWGRM-INIZCTEOSA-N

MDL Number (MFCD)

MFCD16624159

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.458

Distribution Coefficient, logD

3.458

Water Solubility, LogSw

-3.88

Polar Surface Area

52.460

Acid Dissociation Constant (pKa)

15.61

Base Dissociation Constant (pKb)

4.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

Y041-4970 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y041-4970 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-4970?
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What is the minimum amount of Y041-4970 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-4970
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-4970
  • 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 Y041-4970 available by request