G856-5981 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]-4-fluorobenzamide

G856-5981 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]-4-fluorobenzamide
G856-5981 Screening compound: N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-5981
N-[3-(1,3-benzothiazol-2-yl)-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridin-2-yl]-4-fluorobenzamide

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

G856-5981

Molecular Formula

C23H20FN3OS2 (C23 H20 FN3 OS2)

Compound Name

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

IUPAC name

N-[3-(13-benzothiazol-2-yl)-6-ethyl-4H5H6H7H-thieno[23-c]pyridin-2-yl]-4-fluorobenzamide

SMILES

CCN(CC1)Cc2c1c(-c1nc(cccc3)c3s1)c(NC(c(cc1)ccc1F)=O)s2

InChI

InChI=1S/C23H20FN3OS2/c1-2-27-12-11-16-19(13-27)30-23(26-21(28)14-7-9-15(24)10-8-14)20(16)22-25-17-5-3-4-6-18(17)29-22/h3-10H,2,11-13H2,1H3,(H,26,28)

InChI Key

VLKGPZYZOOFTFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11984289

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.259

Distribution Coefficient, logD

4.547

Water Solubility, LogSw

-5.18

Polar Surface Area

35.964

Acid Dissociation Constant (pKa)

7.29

Base Dissociation Constant (pKb)

6.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

G856-5981 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G856-5981 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-5981?
Check Price and Availability of G856-5981, 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 G856-5981 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-5981
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-5981
  • 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 G856-5981 available by request