8019-0575 Screening compound: 3,6-dichloro-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide

8019-0575 Screening compound: 3,6-dichloro-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide
8019-0575 Screening compound: 3,6-dichloro-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-0575
3,6-dichloro-N-[(pyridin-3-yl)methyl]-1-benzothiophene-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

8019-0575

Molecular Formula

C15H10Cl2N2OS (C15 H10 Cl2 N2 OS)

Compound Name

3,6-dichloro-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide

IUPAC name

36-dichloro-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide

SMILES

O=C(c(sc1c2ccc(Cl)c1)c2Cl)NCc1cnccc1

InChI

InChI=1S/C15H10Cl2N2OS/c16-10-3-4-11-12(6-10)21-14(13(11)17)15(20)19-8-9-2-1-5-18-7-9/h1-7H,8H2,(H,19,20)

InChI Key

QRJSGOWRBQNHBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04174357

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.23

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.014

Distribution Coefficient, logD

4.014

Water Solubility, LogSw

-4.60

Polar Surface Area

34.916

Acid Dissociation Constant (pKa)

12.26

Base Dissociation Constant (pKb)

3.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

8019-0575 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS Targets (44014 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8019-0575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-0575?
Check Price and Availability of 8019-0575, 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 8019-0575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-0575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-0575
  • 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 8019-0575 available by request