Y030-6781 Screening compound: N-(3-chloro-4-fluorophenyl)-2-(phenylsulfanyl)acetamide

Y030-6781 Screening compound: N-(3-chloro-4-fluorophenyl)-2-(phenylsulfanyl)acetamide
Y030-6781 Screening compound: N-(3-chloro-4-fluorophenyl)-2-(phenylsulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-6781
N-(3-chloro-4-fluorophenyl)-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

Y030-6781

Molecular Formula

C14H11ClFNOS (C14 H11 ClFNOS)

Compound Name

N-(3-chloro-4-fluorophenyl)-2-(phenylsulfanyl)acetamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-2-(phenylsulfanyl)acetamide

SMILES

O=C(CSc1ccccc1)Nc(cc1)cc(Cl)c1F

InChI

InChI=1S/C14H11ClFNOS/c15-12-8-10(6-7-13(12)16)17-14(18)9-19-11-4-2-1-3-5-11/h1-8H,9H2,(H,17,18)

InChI Key

DDMWQYKTFSSZPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03558849

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.76

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.052

Distribution Coefficient, logD

4.041

Water Solubility, LogSw

-4.24

Polar Surface Area

23.116

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

-1.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

Y030-6781 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 Y030-6781 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-6781?
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What is the minimum amount of Y030-6781 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-6781
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-6781
  • 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 Y030-6781 available by request