8017-8480 Screening compound: 2-(hydroxymethyl)-5-[5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]tetrahydro-3-furanyl 3,4,5-trimethoxybenzoate

8017-8480 Screening compound: 2-(hydroxymethyl)-5-[5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]tetrahydro-3-furanyl 3,4,5-trimethoxybenzoate
8017-8480 Screening compound: 2-(hydroxymethyl)-5-[5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]tetrahydro-3-furanyl 3,4,5-trimethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-8480
2-(hydroxymethyl)-5-[5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]tetrahydro-3-furanyl 3,4,5-trimethoxybenzoate

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

8017-8480

Molecular Formula

C20H24N2O9 (C20 H24 N2 O9)

Compound Name

2-(hydroxymethyl)-5-[5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl]tetrahydro-3-furanyl 3,4,5-trimethoxybenzoate

IUPAC name

2-(hydroxymethyl)-5-(5-methyl-24-dioxo-1234-tetrahydropyrimidin-1-yl)oxolan-3-yl 345-trimethoxybenzoate

SMILES

CC(C(N1)=O)=CN(C(C2)OC(CO)C2OC(c(cc2OC)cc(OC)c2OC)=O)C1=O

InChI

InChI=1S/C20H24N2O9/c1-10-8-22(20(26)21-18(10)24)16-7-12(15(9-23)30-16)31-19(25)11-5-13(27-2)17(29-4)14(6-11)28-3/h5-6,8,12,15-16,23H,7,9H2,1-4H3,(H,21,24,26)

InChI Key

DPULHNLEGSNNNS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06618680

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.42

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.703

Distribution Coefficient, logD

0.702

Water Solubility, LogSw

-1.97

Polar Surface Area

109.308

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

-1.75

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

45.00

8017-8480 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 8017-8480 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-8480?
Check Price and Availability of 8017-8480, 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 8017-8480 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-8480
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-8480
  • 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 8017-8480 available by request