S342-0135 Screening compound: [5-(2-THIENYL)-1

S342-0135 Screening compound: [5-(2-THIENYL)-1
S342-0135 Screening compound: [5-(2-THIENYL)-1 alternative view

Chemical Structure Depiction of ChemDiv screening compound S342-0135
[5-(2-THIENYL)-1

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

S342-0135

Molecular Formula

C13H12N4O5S2 (C13 H12 N4 O5 S2)

Compound Name

[5-(2-THIENYL)-1

IUPAC name

n/a

SMILES

CC(C(C(OCc1noc(-c2cccs2)n1)=O)=CN1C)=NS1(=O)=O

InChI

InChI=1S/C13H12N4O5S2/c1-8-9(6-17(2)24(19,20)16-8)13(18)21-7-11-14-12(22-15-11)10-4-3-5-23-10/h3-6H,7H2,1-2H3

InChI Key

VZHHLYNFOBRDNW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28998467

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.39

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.794

Distribution Coefficient, logD

0.794

Water Solubility, LogSw

-2.03

Polar Surface Area

98.269

Acid Dissociation Constant (pKa)

26.42

Base Dissociation Constant (pKb)

-4.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

S342-0135 in Drug Discovery

Included in Screening Libraries

MEF2-HDAC (class II) Modulators Library (5147 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Female
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • Epigenetic

References: we are preparing a list of scientific research reports with S342-0135 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S342-0135?
Check Price and Availability of S342-0135, 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 S342-0135 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S342-0135
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S342-0135
  • 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 S342-0135 available by request