E540-0235 Screening compound: (5-methylthiophen-3-yl)methanethiol

E540-0235 Screening compound: (5-methylthiophen-3-yl)methanethiol
E540-0235 Screening compound: (5-methylthiophen-3-yl)methanethiol alternative view

Chemical Structure Depiction of ChemDiv screening compound E540-0235
(5-methylthiophen-3-yl)methanethiol

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

E540-0235

Molecular Formula

C6H8S2 (C6 H8 S2)

Compound Name

(5-methylthiophen-3-yl)methanethiol

IUPAC name

(5-methylthiophen-3-yl)methanethiol

SMILES

Cc1cc(CS)cs1

InChI

InChI=1S/C6H8S2/c1-5-2-6(3-7)4-8-5/h2,4,7H,3H2,1H3

InChI Key

KNFKDBWSFIGTIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14897197

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

144.26

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

n/a

Partition Coefficient, logP

2.701

Distribution Coefficient, logD

2.701

Water Solubility, LogSw

-2.58

Polar Surface Area

0.000

Acid Dissociation Constant (pKa)

10.59

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

E540-0235 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with E540-0235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E540-0235?
Check Price and Availability of E540-0235, 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 E540-0235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E540-0235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E540-0235
  • 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 E540-0235 available by request