Y020-9831 Screening compound: 3,6-dimethyl-1-phenyl-1H,4H-pyrano[4,3-c]pyrazol-4-one

Y020-9831 Screening compound: 3,6-dimethyl-1-phenyl-1H,4H-pyrano[4,3-c]pyrazol-4-one
Y020-9831 Screening compound: 3,6-dimethyl-1-phenyl-1H,4H-pyrano[4,3-c]pyrazol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-9831
3,6-dimethyl-1-phenyl-1H,4H-pyrano[4,3-c]pyrazol-4-one

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

Y020-9831

Molecular Formula

C14H12N2O2 (C14 H12 N2 O2)

Compound Name

3,6-dimethyl-1-phenyl-1H,4H-pyrano[4,3-c]pyrazol-4-one

IUPAC name

36-dimethyl-1-phenyl-1H4H-pyrano[43-c]pyrazol-4-one

SMILES

Cc(c1c2C=C(C)OC1=O)nn2-c1ccccc1

InChI

InChI=1S/C14H12N2O2/c1-9-8-12-13(14(17)18-9)10(2)15-16(12)11-6-4-3-5-7-11/h3-8H,1-2H3

InChI Key

QFLNHAGJDXPCGY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01029081

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.217

Distribution Coefficient, logD

2.217

Water Solubility, LogSw

-2.40

Polar Surface Area

37.096

Acid Dissociation Constant (pKa)

30.44

Base Dissociation Constant (pKb)

-3.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

Y020-9831 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y020-9831 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-9831?
Check Price and Availability of Y020-9831, 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 Y020-9831 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-9831
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-9831
  • 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 Y020-9831 available by request