C226-2575 Screening compound: 5-methyl-N-[2-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of ChemDiv screening compound C226-2575
5-methyl-N-[2-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
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
C226-2575
Molecular Formula
C12H9F3N2O2 (C12 H9 F3 N2 O2)
Compound Name
5-methyl-N-[2-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
IUPAC name
5-methyl-N-[2-(trifluoromethyl)phenyl]-12-oxazole-3-carboxamide
SMILES
Cc1cc(C(Nc2c(C(F)(F)F)cccc2)=O)no1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
270.21
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
3.121
Distribution Coefficient, logD
3.121
Water Solubility, LogSw
-3.63
Polar Surface Area
43.860
Acid Dissociation Constant (pKa)
11.92
Base Dissociation Constant (pKb)
-3.21
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
16.70
C226-2575 in Drug Discovery
Included in Screening Libraries
3D-Biodiversity Library (27607 compounds)
Antiparasite Library (23996 compounds)
Antiviral Annotated Library (21441 compounds)
Dark Chemical Matter Library (18430 compounds)
Fragments Library (11262 compounds)
Selective Target Activity Profiling Library (14702 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Epitranscriptome Focused Small Molecule Library (20952 compounds)
Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)
Included in 1.7M Stock Database
- 3D
- Pool
- Fragments
- Infections
- Immune system
- animal
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Nervous system
- Hemic and lymphatic
- Congenital
- Metabolic
- Agro
- Proteases
- Epigenetic
References: we are preparing a list of scientific research reports with C226-2575 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)