8003-4594 Screening compound: 3-amino-N-(3-methylphenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide

8003-4594 Screening compound: 3-amino-N-(3-methylphenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
8003-4594 Screening compound: 3-amino-N-(3-methylphenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-4594
3-amino-N-(3-methylphenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-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

8003-4594

Molecular Formula

C19H15N3OS2 (C19 H15 N3 OS2)

Compound Name

3-amino-N-(3-methylphenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide

IUPAC name

3-amino-N-(3-methylphenyl)-6-(thiophen-2-yl)thieno[23-b]pyridine-2-carboxamide

SMILES

Cc1cccc(NC(c(sc2nc(-c3cccs3)ccc22)c2N)=O)c1

InChI

InChI=1S/C19H15N3OS2/c1-11-4-2-5-12(10-11)21-18(23)17-16(20)13-7-8-14(22-19(13)25-17)15-6-3-9-24-15/h2-10H,20H2,1H3,(H,21,23)

InChI Key

HGGOFEQFYMLEFM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00743902

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.055

Distribution Coefficient, logD

5.055

Water Solubility, LogSw

-4.91

Polar Surface Area

53.183

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

2.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

8003-4594 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8003-4594 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-4594?
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What is the minimum amount of 8003-4594 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-4594
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-4594
  • 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 8003-4594 available by request