R052-0877 Screening compound: 5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione
Chemical Structure Depiction of ChemDiv screening compound R052-0877
5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione
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
R052-0877
Molecular Formula
C4H3FN2O2 (C4 H3 FN2 O2)
Compound Name
5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione
IUPAC name
5-fluoro-1234-tetrahydropyrimidine-24-dione
SMILES
O=C(C(F)=CN1)NC1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
130.08
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
0.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
-0.732
Distribution Coefficient, logD
-1.118
Water Solubility, LogSw
-1.18
Polar Surface Area
49.010
Acid Dissociation Constant (pKa)
7.24
Base Dissociation Constant (pKb)
-3.65
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
0.00
R052-0877 in Drug Discovery
Included in Screening Libraries
Antiviral Annotated Library (21441 compounds)
Fragments Library (11262 compounds)
Human GPCR Annotated Library (5539 compounds)
Human Receptors Annotated Library (5376 compounds)
Human Transcription Factors Annotated Library (5098 compounds)
Launched & Clinically Evaluated Drugs Library (185 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
- Fragments
References: we are preparing a list of scientific research reports with R052-0877 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)