C186-0008 Screening compound: N-(2,4-dimethoxyphenyl)-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide

C186-0008 Screening compound: N-(2,4-dimethoxyphenyl)-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide
C186-0008 Screening compound: N-(2,4-dimethoxyphenyl)-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C186-0008
N-(2,4-dimethoxyphenyl)-4-oxo-4H-thieno[3,2-c]chromene-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

C186-0008

Molecular Formula

C20H15NO5S (C20 H15 NO5 S)

Compound Name

N-(2,4-dimethoxyphenyl)-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide

IUPAC name

N-(24-dimethoxyphenyl)-4-oxo-4H-thieno[32-c]chromene-2-carboxamide

SMILES

COc(cc1)cc(OC)c1NC(c1cc(C(Oc2c-3cccc2)=O)c3s1)=O

InChI

InChI=1S/C20H15NO5S/c1-24-11-7-8-14(16(9-11)25-2)21-19(22)17-10-13-18(27-17)12-5-3-4-6-15(12)26-20(13)23/h3-10H,1-2H3,(H,21,22)

InChI Key

TZAWXPMBEYFDAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02643130

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.260

Distribution Coefficient, logD

4.259

Water Solubility, LogSw

-4.54

Polar Surface Area

59.474

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

-1.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

C186-0008 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C186-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C186-0008?
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What is the minimum amount of C186-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C186-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C186-0008
  • 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 C186-0008 available by request