G189-2022 Screening compound: ethyl 5-{3-[(2,4-dimethoxyphenyl)sulfamoyl]-4-methoxyphenyl}-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of ChemDiv screening compound G189-2022
ethyl 5-{3-[(2,4-dimethoxyphenyl)sulfamoyl]-4-methoxyphenyl}-1,2-oxazole-3-carboxylate
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
G189-2022
Molecular Formula
C21H22N2O8S (C21 H22 N2 O8 S)
Compound Name
ethyl 5-{3-[(2,4-dimethoxyphenyl)sulfamoyl]-4-methoxyphenyl}-1,2-oxazole-3-carboxylate
IUPAC name
ethyl 5-{3-[(24-dimethoxyphenyl)sulfamoyl]-4-methoxyphenyl}-12-oxazole-3-carboxylate
SMILES
CCOC(c1noc(-c(cc2)cc(S(Nc(ccc(OC)c3)c3OC)(=O)=O)c2OC)c1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
462.48
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
3.332
Distribution Coefficient, logD
2.580
Water Solubility, LogSw
-3.67
Polar Surface Area
105.284
Acid Dissociation Constant (pKa)
6.73
Base Dissociation Constant (pKb)
-7.91
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
23.80
G189-2022 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Targeted Diversity Library (40567 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
References: we are preparing a list of scientific research reports with G189-2022 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)