8002-7168 Screening compound: [5-(4-amino-2-oxo-12-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate

8002-7168 Screening compound: [5-(4-amino-2-oxo-12-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate
8002-7168 Screening compound: [5-(4-amino-2-oxo-12-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-7168
[5-(4-amino-2-oxo-12-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate

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

8002-7168

Molecular Formula

C9H13N3O7P (C9 H13 N3 O7 P)

Compound Name

[5-(4-amino-2-oxo-12-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate

IUPAC name

[5-(4-amino-2-oxo-12-dihydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate

SMILES

NC(C=CN1C(C2)OC(COP([O-])(O)=O)C2O)=NC1=O

InChI

InChI=1S/C9H14N3O7P/c10-7-1-2-12(9(14)11-7)8-3-5(13)6(19-8)4-18-20(15,16)17/h1-2,5-6,8,13H,3-4H2,(H2,10,11,14)(H2,15,16,17)/p-1

InChI Key

NCMVOABPESMRCP-UHFFFAOYSA-M

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

Na+

Molecular Weight

306.19

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-3.272

Distribution Coefficient, logD

-4.799

Water Solubility, LogSw

-0.30

Polar Surface Area

121.320

Acid Dissociation Constant (pKa)

5.89

Base Dissociation Constant (pKb)

2.77

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

55.56

8002-7168 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 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 8002-7168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-7168?
Check Price and Availability of 8002-7168, 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 8002-7168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-7168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-7168
  • 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 8002-7168 available by request