5350-0718 Screening compound: 2-(2H-1,3-benzodioxole-5-carbonyl)-6-methyl-4-(thiophen-2-yl)thieno[2,3-b]pyridin-3-amine

5350-0718 Screening compound: 2-(2H-1,3-benzodioxole-5-carbonyl)-6-methyl-4-(thiophen-2-yl)thieno[2,3-b]pyridin-3-amine
5350-0718 Screening compound: 2-(2H-1,3-benzodioxole-5-carbonyl)-6-methyl-4-(thiophen-2-yl)thieno[2,3-b]pyridin-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5350-0718
2-(2H-1,3-benzodioxole-5-carbonyl)-6-methyl-4-(thiophen-2-yl)thieno[2,3-b]pyridin-3-amine

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

5350-0718

Molecular Formula

C20H14N2O3S2 (C20 H14 N2 O3 S2)

Compound Name

2-(2H-1,3-benzodioxole-5-carbonyl)-6-methyl-4-(thiophen-2-yl)thieno[2,3-b]pyridin-3-amine

IUPAC name

2-(2H-13-benzodioxole-5-carbonyl)-6-methyl-4-(thiophen-2-yl)thieno[23-b]pyridin-3-amine

SMILES

Cc1cc(-c2cccs2)c(c(N)c(C(c(cc2)cc3c2OCO3)=O)s2)c2n1

InChI

InChI=1S/C20H14N2O3S2/c1-10-7-12(15-3-2-6-26-15)16-17(21)19(27-20(16)22-10)18(23)11-4-5-13-14(8-11)25-9-24-13/h2-8H,9,21H2,1H3

InChI Key

TZVVPYZXGLGALB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03234563

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.006

Distribution Coefficient, logD

5.005

Water Solubility, LogSw

-4.97

Polar Surface Area

60.481

Acid Dissociation Constant (pKa)

21.03

Base Dissociation Constant (pKb)

4.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

5350-0718 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Ion Channels
  • Others

References: we are preparing a list of scientific research reports with 5350-0718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5350-0718?
Check Price and Availability of 5350-0718, 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 5350-0718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5350-0718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5350-0718
  • 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 5350-0718 available by request