3616-1933 Screening compound: 3-chloro-N-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-benzothiophene-2-carboxamide

3616-1933 Screening compound: 3-chloro-N-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-benzothiophene-2-carboxamide
3616-1933 Screening compound: 3-chloro-N-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3616-1933
3-chloro-N-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-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

3616-1933

Molecular Formula

C21H12ClN3O2S (C21 H12 ClN3 O2 S)

Compound Name

3-chloro-N-(3-{[1,3]oxazolo[4,5-b]pyridin-2-yl}phenyl)-1-benzothiophene-2-carboxamide

IUPAC name

3-chloro-N-(3-{[13]oxazolo[45-b]pyridin-2-yl}phenyl)-1-benzothiophene-2-carboxamide

SMILES

O=C(c(sc1c2cccc1)c2Cl)Nc1cc(-c2nc(nccc3)c3o2)ccc1

InChI

InChI=1S/C21H12ClN3O2S/c22-17-14-7-1-2-9-16(14)28-18(17)20(26)24-13-6-3-5-12(11-13)21-25-19-15(27-21)8-4-10-23-19/h1-11H,(H,24,26)

InChI Key

CVZYBAOYASKAEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02615174

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.86

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.471

Distribution Coefficient, logD

5.471

Water Solubility, LogSw

-6.15

Polar Surface Area

51.261

Acid Dissociation Constant (pKa)

11.64

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3616-1933 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Phosphatases Annotated Library (206 compounds)

Human Proteases Annotated Library (2868 compounds)

Human Receptors Annotated Library (5376 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Proteases
  • Phosphatases

References: we are preparing a list of scientific research reports with 3616-1933 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3616-1933?
Check Price and Availability of 3616-1933, 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 3616-1933 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3616-1933
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3616-1933
  • 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 3616-1933 available by request