0083-0069 Screening compound: 4-[(4-aminophenyl)sulfanyl]aniline

0083-0069 Screening compound: 4-[(4-aminophenyl)sulfanyl]aniline
0083-0069 Screening compound: 4-[(4-aminophenyl)sulfanyl]aniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 0083-0069
4-[(4-aminophenyl)sulfanyl]aniline

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

0083-0069

Molecular Formula

C12H12N2S (C12 H12 N2 S)

Compound Name

4-[(4-aminophenyl)sulfanyl]aniline

IUPAC name

4-[(4-aminophenyl)sulfanyl]aniline

SMILES

Nc(cc1)ccc1Sc(cc1)ccc1N

InChI

InChI=1S/C12H12N2S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,13-14H2

InChI Key

ICNFHJVPAJKPHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00025342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

216.31

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.253

Distribution Coefficient, logD

2.253

Water Solubility, LogSw

-2.24

Polar Surface Area

41.579

Acid Dissociation Constant (pKa)

22.25

Base Dissociation Constant (pKb)

4.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0083-0069 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Receptors Annotated Library (5376 compounds)

Launched & Clinically Evaluated Drugs Library (185 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0083-0069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0083-0069?
Check Price and Availability of 0083-0069, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0083-0069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0083-0069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0083-0069
  • 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 0083-0069 available by request