8007-6625 Screening compound: 4-(acetyloxy)-2-[(acetyloxy)methyl]-5-[4-hydroxy-2-thioxo-1(2H)-pyrimidinyl]tetrahydro-3-furanyl acetate

8007-6625 Screening compound: 4-(acetyloxy)-2-[(acetyloxy)methyl]-5-[4-hydroxy-2-thioxo-1(2H)-pyrimidinyl]tetrahydro-3-furanyl acetate
8007-6625 Screening compound: 4-(acetyloxy)-2-[(acetyloxy)methyl]-5-[4-hydroxy-2-thioxo-1(2H)-pyrimidinyl]tetrahydro-3-furanyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-6625
4-(acetyloxy)-2-[(acetyloxy)methyl]-5-[4-hydroxy-2-thioxo-1(2H)-pyrimidinyl]tetrahydro-3-furanyl 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

8007-6625

Molecular Formula

C15H18N2O8S (C15 H18 N2 O8 S)

Compound Name

4-(acetyloxy)-2-[(acetyloxy)methyl]-5-[4-hydroxy-2-thioxo-1(2H)-pyrimidinyl]tetrahydro-3-furanyl acetate

IUPAC name

[34-bis(acetyloxy)-5-(4-hydroxy-2-sulfanylidene-12-dihydropyrimidin-1-yl)oxolan-2-yl]methyl acetate

SMILES

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

InChI

InChI=1S/C15H18N2O8S/c1-7(18)22-6-10-12(23-8(2)19)13(24-9(3)20)14(25-10)17-5-4-11(21)16-15(17)26/h4-5,10,12-14H,6H2,1-3H3,(H,16,21,26)

InChI Key

YKDNCFTUUKOENT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01239703

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.38

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.206

Distribution Coefficient, logD

-3.688

Water Solubility, LogSw

-1.08

Polar Surface Area

97.631

Acid Dissociation Constant (pKa)

3.92

Base Dissociation Constant (pKb)

1.11

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

53.33

8007-6625 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 8007-6625 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-6625?
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What is the minimum amount of 8007-6625 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-6625
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-6625
  • 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 8007-6625 available by request