8020-2503 Screening compound: 4-hydroxy-1-[4-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]-5-methyl-1,2-dihydropyrimidin-2-one

8020-2503 Screening compound: 4-hydroxy-1-[4-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]-5-methyl-1,2-dihydropyrimidin-2-one
8020-2503 Screening compound: 4-hydroxy-1-[4-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]-5-methyl-1,2-dihydropyrimidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-2503
4-hydroxy-1-[4-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]-5-methyl-1,2-dihydropyrimidin-2-one

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

8020-2503

Molecular Formula

C10H12N2O5 (C10 H12 N2 O5)

Compound Name

4-hydroxy-1-[4-(hydroxymethyl)-3,6-dioxabicyclo[3.1.0]hexan-2-yl]-5-methyl-1,2-dihydropyrimidin-2-one

IUPAC name

4-hydroxy-1-[(1S2R4R5S)-4-(hydroxymethyl)-36-dioxabicyclo[3.1.0]hexan-2-yl]-5-methyl-12-dihydropyrimidin-2-one

SMILES

CC(C(O)=N1)=CN([C@H]2O[C@@H](CO)[C@H]3O[C@@H]23)C1=O

InChI

InChI=1S/C10H12N2O5/c1-4-2-12(10(15)11-8(4)14)9-7-6(17-7)5(3-13)16-9/h2,5-7,9,13H,3H2,1H3,(H,11,14,15)/t5-,6-,7-,9+/m1/s1

InChI Key

AXBTVCCVDAUCIY-PULFBKJNSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.22

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.678

Distribution Coefficient, logD

-4.420

Water Solubility, LogSw

-0.21

Polar Surface Area

75.248

Acid Dissociation Constant (pKa)

3.66

Base Dissociation Constant (pKb)

0.65

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

60.00

8020-2503 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

?ysteine Targeted Covalent Library (39471 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 8020-2503 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-2503?
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What is the minimum amount of 8020-2503 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-2503
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-2503
  • 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 8020-2503 available by request