G842-0103 Screening compound: butyl 4-{1-[(4-fluorophenyl)methyl]-2-oxo-1,2-dihydropyridine-3-amido}benzoate
Chemical Structure Depiction of ChemDiv screening compound G842-0103
butyl 4-{1-[(4-fluorophenyl)methyl]-2-oxo-1,2-dihydropyridine-3-amido}benzoate
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
G842-0103
Molecular Formula
C24H23FN2O4 (C24 H23 FN2 O4)
Compound Name
butyl 4-{1-[(4-fluorophenyl)methyl]-2-oxo-1,2-dihydropyridine-3-amido}benzoate
IUPAC name
butyl 4-{1-[(4-fluorophenyl)methyl]-2-oxo-12-dihydropyridine-3-amido}benzoate
SMILES
CCCCOC(c(cc1)ccc1NC(C1=CC=CN(Cc(cc2)ccc2F)C1=O)=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
422.46
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.460
Distribution Coefficient, logD
3.848
Water Solubility, LogSw
-4.24
Polar Surface Area
60.092
Acid Dissociation Constant (pKa)
6.91
Base Dissociation Constant (pKb)
-1.63
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
20.80
G842-0103 in Drug Discovery
Included in Screening Libraries
CORONAVIRUS Library (20774 compounds)
PLpro Library (6343 compounds)
Histone Deacetylases (HDAC) Targeted Library (9760 compounds)
Peptidomimetic Library (37031 compounds)
Included in 1.7M Stock Database
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Cancer
- Nervous system
- Hemic and lymphatic
- Endocrine
- Immune system
- Epigenetic
- PPI modulators
- Mimetics
References: we are preparing a list of scientific research reports with G842-0103 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)