3057-1568 Screening compound: 2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(Z)-(2-methoxynaphthalen-1-yl)methylidene]acetohydrazide

3057-1568 Screening compound: 2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(Z)-(2-methoxynaphthalen-1-yl)methylidene]acetohydrazide
3057-1568 Screening compound: 2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(Z)-(2-methoxynaphthalen-1-yl)methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3057-1568
2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(Z)-(2-methoxynaphthalen-1-yl)methylidene]acetohydrazide

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

3057-1568

Molecular Formula

C17H16N6O4 (C17 H16 N6 O4)

Compound Name

2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(Z)-(2-methoxynaphthalen-1-yl)methylidene]acetohydrazide

IUPAC name

2-[(35-dioxo-2345-tetrahydro-124-triazin-6-yl)amino]-N'-[(Z)-(2-methoxynaphthalen-1-yl)methylidene]acetohydrazide

SMILES

COc1c(/C=N\NC(CNC(C(N2)=O)=NNC2=O)=O)c2ccccc2cc1

InChI

InChI=1S/C17H16N6O4/c1-27-13-7-6-10-4-2-3-5-11(10)12(13)8-19-21-14(24)9-18-15-16(25)20-17(26)23-22-15/h2-8H,9H2,1H3,(H,18,22)(H,21,24)(H2,20,23,25,26)

InChI Key

TXWPFYSIHLVQGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01848848

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.35

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.234

Distribution Coefficient, logD

0.055

Water Solubility, LogSw

-2.63

Polar Surface Area

115.446

Acid Dissociation Constant (pKa)

6.25

Base Dissociation Constant (pKb)

1.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

3057-1568 in Drug Discovery

Included in Screening Libraries

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3057-1568 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3057-1568?
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What is the minimum amount of 3057-1568 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3057-1568
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3057-1568
  • 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 3057-1568 available by request