1988-0299 Screening compound: 2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-phenylmethylidene]acetohydrazide

1988-0299 Screening compound: 2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-phenylmethylidene]acetohydrazide
1988-0299 Screening compound: 2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-phenylmethylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1988-0299
2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-phenylmethylidene]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

1988-0299

Molecular Formula

C12H11N5O3 (C12 H11 N5 O3)

Compound Name

2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-phenylmethylidene]acetohydrazide

IUPAC name

2-(35-dioxo-2345-tetrahydro-124-triazin-6-yl)-N'-[(E)-phenylmethylidene]acetohydrazide

SMILES

O=C(CC(C(N1)=O)=NNC1=O)N/N=C/c1ccccc1

InChI

InChI=1S/C12H11N5O3/c18-10(6-9-11(19)14-12(20)17-15-9)16-13-7-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,16,18)(H2,14,17,19,20)

InChI Key

PEFHGNDECNCHLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01181980

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

273.25

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.055

Distribution Coefficient, logD

0.044

Water Solubility, LogSw

-1.97

Polar Surface Area

95.912

Acid Dissociation Constant (pKa)

8.97

Base Dissociation Constant (pKb)

1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

1988-0299 in Drug Discovery

Included in Screening Libraries

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1988-0299 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 1988-0299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1988-0299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1988-0299
  • 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 1988-0299 available by request