2-[4-[(5-oxo-7-propyl-4h-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzoic acid (CHEM326596)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-30 11:21:57 UTC | ||||||||
| Update Date | 2026-08-30 11:21:57 UTC | ||||||||
| Accession Number | CHEM326596 | ||||||||
| Identification | |||||||||
| Common Name | 2-[4-[(5-oxo-7-propyl-4h-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzoic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 2-[4-[(5-oxo-7-propyl-4h-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzoic acid is a compound with the formula C22H20N4O3. It has an average molecular weight of 388.40 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C22H20N4O3 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 388.154 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 2-[4-[(5-oxo-7-propyl-4h-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)methyl]phenyl]benzoic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCCC1=C(C(=O)NC2=NC=NN12)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O | ||||||||
| InChI Identifier | InChI=1S/C22H20N4O3/c1-2-5-19-18(20(27)25-22-23-13-24-26(19)22)12-14-8-10-15(11-9-14)16-6-3-4-7-17(16)21(28)29/h3-4,6-11,13H,2,5,12H2,1H3,(H,28,29)(H,23,24,25,27) | ||||||||
| InChI Key | OREOAKRJKYNIJK-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
