1544-0032 Screening compound: [3,4-bis(acetyloxy)-5-(5-bromo-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl acetate

1544-0032 Screening compound: [3,4-bis(acetyloxy)-5-(5-bromo-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl acetate
1544-0032 Screening compound: [3,4-bis(acetyloxy)-5-(5-bromo-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1544-0032
[3,4-bis(acetyloxy)-5-(5-bromo-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-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

1544-0032

Molecular Formula

C15H17BrN2O9 (C15 H17 BrN2 O9)

Compound Name

[3,4-bis(acetyloxy)-5-(5-bromo-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl acetate

IUPAC name

[34-bis(acetyloxy)-5-(5-bromo-24-dioxo-1234-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl acetate

SMILES

CC(OCC(C(C1OC(C)=O)OC(C)=O)OC1N(C=C(C(N1)=O)Br)C1=O)=O

InChI

InChI=1S/C15H17BrN2O9/c1-6(19)24-5-10-11(25-7(2)20)12(26-8(3)21)14(27-10)18-4-9(16)13(22)17-15(18)23/h4,10-12,14H,5H2,1-3H3,(H,17,22,23)

InChI Key

OVWGEZUVGHETAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01078798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.21

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.289

Distribution Coefficient, logD

0.283

Water Solubility, LogSw

-1.63

Polar Surface Area

110.994

Acid Dissociation Constant (pKa)

9.23

Base Dissociation Constant (pKb)

-4.11

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

53.33

1544-0032 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

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 1544-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1544-0032?
Check Price and Availability of 1544-0032, 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 1544-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1544-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1544-0032
  • 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 1544-0032 available by request