8019-8248 Screening compound: N~1~-{1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]-5-methyl-2-oxo-1,2-dihydro-4-pyrimidinyl}benzamide

8019-8248 Screening compound: N~1~-{1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]-5-methyl-2-oxo-1,2-dihydro-4-pyrimidinyl}benzamide
8019-8248 Screening compound: N~1~-{1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]-5-methyl-2-oxo-1,2-dihydro-4-pyrimidinyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8248
N~1~-{1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]-5-methyl-2-oxo-1,2-dihydro-4-pyrimidinyl}benzamide

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

8019-8248

Molecular Formula

C17H19N3O5 (C17 H19 N3 O5)

Compound Name

N~1~-{1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydro-2-furanyl]-5-methyl-2-oxo-1,2-dihydro-4-pyrimidinyl}benzamide

IUPAC name

N-{1-[(2R5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2-oxo-12-dihydropyrimidin-4-yl}benzamide

SMILES

CC(C(NC(c1ccccc1)=O)=N1)=CN([C@H](C2)O[C@@H](CO)C2O)C1=O

InChI

InChI=1S/C17H19N3O5/c1-10-8-20(14-7-12(22)13(9-21)25-14)17(24)19-15(10)18-16(23)11-5-3-2-4-6-11/h2-6,8,12-14,21-22H,7,9H2,1H3,(H,18,19,23,24)/t12?,13-,14+/m1/s1

InChI Key

VYJDMDIVDHHLGK-IUZLNWEFSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.329

Distribution Coefficient, logD

-0.051

Water Solubility, LogSw

-1.69

Polar Surface Area

89.925

Acid Dissociation Constant (pKa)

7.25

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

35.29

8019-8248 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 8019-8248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8248?
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What is the minimum amount of 8019-8248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8248
  • 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 8019-8248 available by request