Y030-4126 Screening compound: N-[(2-methoxyphenyl)methyl]-2-phenyl-2-(phenylsulfanyl)acetamide

Y030-4126 Screening compound: N-[(2-methoxyphenyl)methyl]-2-phenyl-2-(phenylsulfanyl)acetamide
Y030-4126 Screening compound: N-[(2-methoxyphenyl)methyl]-2-phenyl-2-(phenylsulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-4126
N-[(2-methoxyphenyl)methyl]-2-phenyl-2-(phenylsulfanyl)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

Y030-4126

Molecular Formula

C22H21NO2S (C22 H21 NO2 S)

Compound Name

N-[(2-methoxyphenyl)methyl]-2-phenyl-2-(phenylsulfanyl)acetamide

IUPAC name

N-[(2-methoxyphenyl)methyl]-2-phenyl-2-(phenylsulfanyl)acetamide

SMILES

COc1c(CNC(C(c2ccccc2)Sc2ccccc2)=O)cccc1

InChI

InChI=1S/C22H21NO2S/c1-25-20-15-9-8-12-18(20)16-23-22(24)21(17-10-4-2-5-11-17)26-19-13-6-3-7-14-19/h2-15,21H,16H2,1H3,(H,23,24)/t21-/m1/s1

InChI Key

PRRAXJNOJKLTLL-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD02038896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.923

Distribution Coefficient, logD

4.923

Water Solubility, LogSw

-4.69

Polar Surface Area

32.011

Acid Dissociation Constant (pKa)

12.28

Base Dissociation Constant (pKb)

-1.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.60

Y030-4126 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y030-4126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-4126?
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What is the minimum amount of Y030-4126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-4126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-4126
  • 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 Y030-4126 available by request