C201-0127 Screening compound: 7-hydroxy-2-oxo-2H-chromene-3-carbothioamide

C201-0127 Screening compound: 7-hydroxy-2-oxo-2H-chromene-3-carbothioamide
C201-0127 Screening compound: 7-hydroxy-2-oxo-2H-chromene-3-carbothioamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0127
7-hydroxy-2-oxo-2H-chromene-3-carbothioamide

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

C201-0127

Molecular Formula

C10H7NO3S (C10 H7 NO3 S)

Compound Name

7-hydroxy-2-oxo-2H-chromene-3-carbothioamide

IUPAC name

7-hydroxy-2-oxo-2H-chromene-3-carbothioamide

SMILES

NC(C1=Cc(ccc(O)c2)c2OC1=O)=S

InChI

InChI=1S/C10H7NO3S/c11-9(15)7-3-5-1-2-6(12)4-8(5)14-10(7)13/h1-4,12H,(H2,11,15)

InChI Key

QRYYSXMCHMIEIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00488460

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

221.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.922

Distribution Coefficient, logD

0.849

Water Solubility, LogSw

-1.95

Polar Surface Area

58.230

Acid Dissociation Constant (pKa)

8.14

Base Dissociation Constant (pKb)

-0.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

C201-0127 in Drug Discovery

Included in Screening Libraries

CNS Annotated Library (688 compounds)

CORONAVIRUS Library (20774 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Human GPCR Annotated Library (5539 compounds)

PLpro Library (6343 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C201-0127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0127?
Check Price and Availability of C201-0127, 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 C201-0127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0127
  • 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 C201-0127 available by request