3966-0284 Screening compound: [3,4,5-tris(acetyloxy)-6-{4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl}oxan-2-yl]methyl acetate

3966-0284 Screening compound: [3,4,5-tris(acetyloxy)-6-{4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl}oxan-2-yl]methyl acetate
3966-0284 Screening compound: [3,4,5-tris(acetyloxy)-6-{4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl}oxan-2-yl]methyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3966-0284
[3,4,5-tris(acetyloxy)-6-{4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl}oxan-2-yl]methyl acetate

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

3966-0284

Molecular Formula

C19H22N4O10 (C19 H22 N4 O10)

Compound Name

[3,4,5-tris(acetyloxy)-6-{4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-5-yl}oxan-2-yl]methyl acetate

IUPAC name

[345-tris(acetyloxy)-6-{4-oxo-1H4H5H-pyrazolo[34-d]pyrimidin-5-yl}oxan-2-yl]methyl acetate

SMILES

CC(OCC(C(C(C1OC(C)=O)OC(C)=O)OC(C)=O)OC1N(C=Nc1c2cn[nH]1)C2=O)=O

InChI

InChI=1S/C19H22N4O10/c1-8(24)29-6-13-14(30-9(2)25)15(31-10(3)26)16(32-11(4)27)19(33-13)23-7-20-17-12(18(23)28)5-21-22-17/h5,7,13-16,19H,6H2,1-4H3,(H,21,22)

InChI Key

NXLUSDAHBPGUAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01898071

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.4

Hydrogen Bond Acceptors Count

17.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

14

Partition Coefficient, logP

-0.448

Distribution Coefficient, logD

-0.451

Water Solubility, LogSw

-1.29

Polar Surface Area

140.036

Acid Dissociation Constant (pKa)

9.49

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

52.60

3966-0284 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

Akt-Targeted Library (14764 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Structure:
  • Mimetics
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3966-0284 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3966-0284?
Check Price and Availability of 3966-0284, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3966-0284 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3966-0284
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3966-0284
  • 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 3966-0284 available by request