Y020-9593 Screening compound: 2-(methylsulfanyl)-7-(1-naphthyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one

Y020-9593 Screening compound: 2-(methylsulfanyl)-7-(1-naphthyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
Y020-9593 Screening compound: 2-(methylsulfanyl)-7-(1-naphthyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-9593
2-(methylsulfanyl)-7-(1-naphthyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-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

Y020-9593

Molecular Formula

C18H12N6OS (C18 H12 N6 OS)

Compound Name

2-(methylsulfanyl)-7-(1-naphthyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one

IUPAC name

4-(methylsulfanyl)-11-(naphthalen-1-yl)-2357811-hexaazatricyclo[7.4.0.0^{26}]trideca-1(9)35712-pentaen-10-one

SMILES

CSc1nn2c(C=CN(c3cccc4ccccc34)C3=O)c3nnc2n1

InChI

InChI=1S/C18H12N6OS/c1-26-18-19-17-21-20-15-14(24(17)22-18)9-10-23(16(15)25)13-8-4-6-11-5-2-3-7-12(11)13/h2-10H,1H3

InChI Key

OSFSDRBMTZHEIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD21610109

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

360.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.999

Distribution Coefficient, logD

3.999

Water Solubility, LogSw

-4.12

Polar Surface Area

62.258

Acid Dissociation Constant (pKa)

26.23

Base Dissociation Constant (pKb)

1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

Y020-9593 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y020-9593 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of Y020-9593 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-9593
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-9593
  • 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 Y020-9593 available by request