3033-1728 Screening compound: 2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N'-[(2-hydroxyphenyl)methylidene]acetohydrazide

3033-1728 Screening compound: 2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N'-[(2-hydroxyphenyl)methylidene]acetohydrazide
3033-1728 Screening compound: 2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N'-[(2-hydroxyphenyl)methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3033-1728
2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N'-[(2-hydroxyphenyl)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

3033-1728

Molecular Formula

C16H16N6O4 (C16 H16 N6 O4)

Compound Name

2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N'-[(2-hydroxyphenyl)methylidene]acetohydrazide

IUPAC name

2-(13-dimethyl-26-dioxo-2369-tetrahydro-1H-purin-9-yl)-N'-[(2-hydroxyphenyl)methylidene]acetohydrazide

SMILES

CN(c1c(C(N2C)=O)ncn1CC(NN=Cc(cccc1)c1O)=O)C2=O

InChI

InChI=1S/C16H16N6O4/c1-20-14-13(15(25)21(2)16(20)26)17-9-22(14)8-12(24)19-18-7-10-5-3-4-6-11(10)23/h3-7,9,23H,8H2,1-2H3,(H,19,24)

InChI Key

JAIWOKCPTDVFFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01786190

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.34

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.783

Distribution Coefficient, logD

0.782

Water Solubility, LogSw

-2.03

Polar Surface Area

94.826

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

1.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

3033-1728 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with 3033-1728 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3033-1728?
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What is the minimum amount of 3033-1728 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3033-1728
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3033-1728
  • 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 3033-1728 available by request