1988-0300 Screening compound: 2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide

1988-0300 Screening compound: 2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide
1988-0300 Screening compound: 2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1988-0300
2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-[(E)-(2-hydroxynaphthalen-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

1988-0300

Molecular Formula

C16H13N5O4 (C16 H13 N5 O4)

Compound Name

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

IUPAC name

2-(35-dioxo-2345-tetrahydro-124-triazin-6-yl)-N'-[(E)-(2-hydroxynaphthalen-1-yl)methylidene]acetohydrazide

SMILES

Oc1c(/C=N/NC(CC(C(N2)=O)=NNC2=O)=O)c2ccccc2cc1

InChI

InChI=1S/C16H13N5O4/c22-13-6-5-9-3-1-2-4-10(9)11(13)8-17-20-14(23)7-12-15(24)18-16(25)21-19-12/h1-6,8,22H,7H2,(H,20,23)(H2,18,21,24,25)

InChI Key

SQGCPNYRAGYYMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01181981

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.31

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.173

Distribution Coefficient, logD

1.161

Water Solubility, LogSw

-2.58

Polar Surface Area

112.189

Acid Dissociation Constant (pKa)

8.97

Base Dissociation Constant (pKb)

2.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

1988-0300 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 1988-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 1988-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1988-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1988-0300
  • 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 1988-0300 available by request