Y020-4768 Screening compound: 2-ethyl-7-(4-methoxyphenyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one

Y020-4768 Screening compound: 2-ethyl-7-(4-methoxyphenyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
Y020-4768 Screening compound: 2-ethyl-7-(4-methoxyphenyl)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 Y020-4768
2-ethyl-7-(4-methoxyphenyl)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

Y020-4768

Molecular Formula

C16H14N6O2 (C16 H14 N6 O2)

Compound Name

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

IUPAC name

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

SMILES

CCc1nn2c(C=CN(c(cc3)ccc3OC)C3=O)c3nnc2n1

InChI

InChI=1S/C16H14N6O2/c1-3-13-17-16-19-18-14-12(22(16)20-13)8-9-21(15(14)23)10-4-6-11(24-2)7-5-10/h4-9H,3H2,1-2H3

InChI Key

AIVYWTHPIBITHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20503325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.464

Distribution Coefficient, logD

2.464

Water Solubility, LogSw

-2.52

Polar Surface Area

72.642

Acid Dissociation Constant (pKa)

30.01

Base Dissociation Constant (pKb)

1.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

Y020-4768 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with Y020-4768 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-4768?
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What is the minimum amount of Y020-4768 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-4768
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-4768
  • 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 Y020-4768 available by request