4476-4904 Screening compound: 3-chloro-N-(4-methylpyridin-2-yl)-1-benzothiophene-2-carboxamide

4476-4904 Screening compound: 3-chloro-N-(4-methylpyridin-2-yl)-1-benzothiophene-2-carboxamide
4476-4904 Screening compound: 3-chloro-N-(4-methylpyridin-2-yl)-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4476-4904
3-chloro-N-(4-methylpyridin-2-yl)-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

4476-4904

Molecular Formula

C15H11ClN2OS (C15 H11 ClN2 OS)

Compound Name

3-chloro-N-(4-methylpyridin-2-yl)-1-benzothiophene-2-carboxamide

IUPAC name

3-chloro-N-(4-methylpyridin-2-yl)-1-benzothiophene-2-carboxamide

SMILES

Cc1cc(NC(c(sc2c3cccc2)c3Cl)=O)ncc1

InChI

InChI=1S/C15H11ClN2OS/c1-9-6-7-17-12(8-9)18-15(19)14-13(16)10-4-2-3-5-11(10)20-14/h2-8H,1H3,(H,17,18,19)

InChI Key

YGVSITNXBOVTTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02220655

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.78

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.366

Distribution Coefficient, logD

4.360

Water Solubility, LogSw

-4.61

Polar Surface Area

33.691

Acid Dissociation Constant (pKa)

9.25

Base Dissociation Constant (pKb)

4.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

4476-4904 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Epigenetic
Targets:
  • Kinases
  • Proteases

References: we are preparing a list of scientific research reports with 4476-4904 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4476-4904?
Check Price and Availability of 4476-4904, 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 4476-4904 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4476-4904
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4476-4904
  • 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 4476-4904 available by request