Y041-4954 Screening compound: 6-[4-(methylsulfanyl)phenyl]-2-[2-oxo-2-(2-phenylmorpholino)ethyl]-3(2H)-pyridazinone

Y041-4954 Screening compound: 6-[4-(methylsulfanyl)phenyl]-2-[2-oxo-2-(2-phenylmorpholino)ethyl]-3(2H)-pyridazinone
Y041-4954 Screening compound: 6-[4-(methylsulfanyl)phenyl]-2-[2-oxo-2-(2-phenylmorpholino)ethyl]-3(2H)-pyridazinone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-4954
6-[4-(methylsulfanyl)phenyl]-2-[2-oxo-2-(2-phenylmorpholino)ethyl]-3(2H)-pyridazinone

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

Y041-4954

Molecular Formula

C23H23N3O3S (C23 H23 N3 O3 S)

Compound Name

6-[4-(methylsulfanyl)phenyl]-2-[2-oxo-2-(2-phenylmorpholino)ethyl]-3(2H)-pyridazinone

IUPAC name

n/a

SMILES

CSc(cc1)ccc1C(C=C1)=NN(CC(N2CC(c3ccccc3)OCC2)=O)C1=O

InChI

InChI=1S/C23H23N3O3S/c1-30-19-9-7-17(8-10-19)20-11-12-22(27)26(24-20)16-23(28)25-13-14-29-21(15-25)18-5-3-2-4-6-18/h2-12,21H,13-16H2,1H3/t21-/m0/s1

InChI Key

GJVDNIXLXIQXMQ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD18796921

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.227

Distribution Coefficient, logD

3.227

Water Solubility, LogSw

-3.32

Polar Surface Area

52.456

Acid Dissociation Constant (pKa)

18.69

Base Dissociation Constant (pKb)

-2.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with Y041-4954 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-4954?
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What is the minimum amount of Y041-4954 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-4954
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-4954
  • 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 Y041-4954 available by request