8008-8218 Screening compound: 5-[(dibutylamino)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid

8008-8218 Screening compound: 5-[(dibutylamino)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid
8008-8218 Screening compound: 5-[(dibutylamino)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-8218
5-[(dibutylamino)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid

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

8008-8218

Molecular Formula

C14H23N3O4 (C14 H23 N3 O4)

Compound Name

5-[(dibutylamino)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid

IUPAC name

5-[(dibutylamino)methyl]-26-dioxo-1236-tetrahydropyrimidine-4-carboxylic acid

SMILES

CCCCN(CCCC)CC(C(N1)=O)=C(C(O)=O)NC1=O

InChI

InChI=1S/C14H23N3O4/c1-3-5-7-17(8-6-4-2)9-10-11(13(19)20)15-14(21)16-12(10)18/h3-9H2,1-2H3,(H,19,20)(H2,15,16,18,21)

InChI Key

ZYACRERYXQHGKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01079105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.35

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.336

Distribution Coefficient, logD

1.336

Water Solubility, LogSw

-1.74

Polar Surface Area

81.622

Acid Dissociation Constant (pKa)

3.77

Base Dissociation Constant (pKb)

8.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.29

8008-8218 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 8008-8218 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-8218?
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What is the minimum amount of 8008-8218 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-8218
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-8218
  • 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 8008-8218 available by request