2516-4814 Screening compound: 7-(2-hydroxy-3-phenoxypropyl)-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazin-1-yl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

2516-4814 Screening compound: 7-(2-hydroxy-3-phenoxypropyl)-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazin-1-yl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
2516-4814 Screening compound: 7-(2-hydroxy-3-phenoxypropyl)-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazin-1-yl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2516-4814
7-(2-hydroxy-3-phenoxypropyl)-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazin-1-yl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

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

2516-4814

Molecular Formula

C24H26N6O5 (C24 H26 N6 O5)

Compound Name

7-(2-hydroxy-3-phenoxypropyl)-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazin-1-yl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

7-(2-hydroxy-3-phenoxypropyl)-8-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazin-1-yl]-3-methyl-2367-tetrahydro-1H-purine-26-dione

SMILES

C/C(/c(cc1)ccc1OC)=N\Nc1nc(N(C)C(NC2=O)=O)c2n1CC(COc1ccccc1)O

InChI

InChI=1S/C24H26N6O5/c1-15(16-9-11-18(34-3)12-10-16)27-28-23-25-21-20(22(32)26-24(33)29(21)2)30(23)13-17(31)14-35-19-7-5-4-6-8-19/h4-12,17,31H,13-14H2,1-3H3,(H,25,28)(H,26,32,33)/t17-/m0/s1

InChI Key

OEBSEYZMZSBSPO-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD01051187

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.586

Distribution Coefficient, logD

3.584

Water Solubility, LogSw

-3.68

Polar Surface Area

105.613

Acid Dissociation Constant (pKa)

9.74

Base Dissociation Constant (pKb)

1.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

2516-4814 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 2516-4814 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2516-4814
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2516-4814
  • 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 2516-4814 available by request