C593-1228 Screening compound: N-benzyl-N-ethyl-8-methyl-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide

C593-1228 Screening compound: N-benzyl-N-ethyl-8-methyl-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide
C593-1228 Screening compound: N-benzyl-N-ethyl-8-methyl-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C593-1228
N-benzyl-N-ethyl-8-methyl-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

C593-1228

Molecular Formula

C22H19NO3S (C22 H19 NO3 S)

Compound Name

N-benzyl-N-ethyl-8-methyl-4-oxo-4H-thieno[3,2-c]chromene-2-carboxamide

IUPAC name

N-benzyl-N-ethyl-8-methyl-4-oxo-4H-thieno[32-c]chromene-2-carboxamide

SMILES

CCN(Cc1ccccc1)C(c1cc(C(Oc2c-3cc(C)cc2)=O)c3s1)=O

InChI

InChI=1S/C22H19NO3S/c1-3-23(13-15-7-5-4-6-8-15)21(24)19-12-17-20(27-19)16-11-14(2)9-10-18(16)26-22(17)25/h4-12H,3,13H2,1-2H3

InChI Key

JGQUYOVUWDUVLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14774050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.940

Distribution Coefficient, logD

4.940

Water Solubility, LogSw

-4.70

Polar Surface Area

37.843

Acid Dissociation Constant (pKa)

28.42

Base Dissociation Constant (pKb)

-4.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

C593-1228 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Ion Channels
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C593-1228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C593-1228?
Check Price and Availability of C593-1228, 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 C593-1228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C593-1228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C593-1228
  • 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 C593-1228 available by request