G856-6028 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-6-benzyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]furan-2-carboxamide

G856-6028 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-6-benzyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]furan-2-carboxamide
G856-6028 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-6-benzyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-6028
N-[3-(1,3-benzothiazol-2-yl)-6-benzyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]furan-2-carboxamide

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

G856-6028

Molecular Formula

C26H21N3O2S2 (C26 H21 N3 O2 S2)

Compound Name

N-[3-(1,3-benzothiazol-2-yl)-6-benzyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]furan-2-carboxamide

IUPAC name

N-[3-(13-benzothiazol-2-yl)-6-benzyl-4H5H6H7H-thieno[23-c]pyridin-2-yl]furan-2-carboxamide

SMILES

O=C(c1ccco1)Nc(sc1c2CCN(Cc3ccccc3)C1)c2-c1nc(cccc2)c2s1

InChI

InChI=1S/C26H21N3O2S2/c30-24(20-10-6-14-31-20)28-26-23(25-27-19-9-4-5-11-21(19)32-25)18-12-13-29(16-22(18)33-26)15-17-7-2-1-3-8-17/h1-11,14H,12-13,15-16H2,(H,28,30)

InChI Key

HPJKELXJIOFHQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11984355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.660

Distribution Coefficient, logD

5.572

Water Solubility, LogSw

-5.78

Polar Surface Area

44.546

Acid Dissociation Constant (pKa)

8.17

Base Dissociation Constant (pKb)

6.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

G856-6028 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with G856-6028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-6028?
Check Price and Availability of G856-6028, 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 G856-6028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-6028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-6028
  • 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 G856-6028 available by request