Y030-4746 Screening compound: N-(2-ethoxyphenyl)-2-phenyl-2-(phenylsulfanyl)acetamide

Y030-4746 Screening compound: N-(2-ethoxyphenyl)-2-phenyl-2-(phenylsulfanyl)acetamide
Y030-4746 Screening compound: N-(2-ethoxyphenyl)-2-phenyl-2-(phenylsulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-4746
N-(2-ethoxyphenyl)-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

Y030-4746

Molecular Formula

C22H21NO2S (C22 H21 NO2 S)

Compound Name

N-(2-ethoxyphenyl)-2-phenyl-2-(phenylsulfanyl)acetamide

IUPAC name

N-(2-ethoxyphenyl)-2-phenyl-2-(phenylsulfanyl)acetamide

SMILES

CCOc(cccc1)c1NC(C(c1ccccc1)Sc1ccccc1)=O

InChI

InChI=1S/C22H21NO2S/c1-2-25-20-16-10-9-15-19(20)23-22(24)21(17-11-5-3-6-12-17)26-18-13-7-4-8-14-18/h3-16,21H,2H2,1H3,(H,23,24)/t21-/m1/s1

InChI Key

QLNDODCQERLOMO-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD02860974

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

5.657

Distribution Coefficient, logD

5.657

Water Solubility, LogSw

-5.53

Polar Surface Area

29.570

Acid Dissociation Constant (pKa)

10.37

Base Dissociation Constant (pKb)

0.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.60

Y030-4746 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with Y030-4746 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-4746?
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What is the minimum amount of Y030-4746 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-4746
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-4746
  • 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 Y030-4746 available by request