3-[4-[4-[4-(1-butan-2-yl-5-oxo-1,2,4-triazol-4-yl)phenyl]piperazin-1-yl]phenoxy]-2-[1-(2,4-dichlorophenyl)-1-hydroxy-2-(1,2,4-triazol-1-yl)ethoxy]propanal (CHEM349615)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 20:46:29 UTC | ||||||||
| Update Date | 2026-08-31 20:46:29 UTC | ||||||||
| Accession Number | CHEM349615 | ||||||||
| Identification | |||||||||
| Common Name | 3-[4-[4-[4-(1-butan-2-yl-5-oxo-1,2,4-triazol-4-yl)phenyl]piperazin-1-yl]phenoxy]-2-[1-(2,4-dichlorophenyl)-1-hydroxy-2-(1,2,4-triazol-1-yl)ethoxy]propanal | ||||||||
| Class | Small Molecule | ||||||||
| Description | 3-[4-[4-[4-(1-butan-2-yl-5-oxo-1,2,4-triazol-4-yl)phenyl]piperazin-1-yl]phenoxy]-2-[1-(2,4-dichlorophenyl)-1-hydroxy-2-(1,2,4-triazol-1-yl)ethoxy]propanal is a compound with the chemical formula C35H38Cl2N8O5. With an average molecular weight of 721.60 g/mol, 3-[4-[4-[4-(1-butan-2-yl-5-oxo-1,2,4-triazol-4-yl)phenyl]piperazin-1-yl]phenoxy]-2-[1-(2,4-dichlorophenyl)-1-hydroxy-2-(1,2,4-triazol-1-yl)ethoxy]propanal is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C35H38Cl2N8O5 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 720.234 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 3-[4-[4-[4-(1-butan-2-yl-5-oxo-1,2,4-triazol-4-yl)phenyl]piperazin-1-yl]phenoxy]-2-[1-(2,4-dichlorophenyl)-1-hydroxy-2-(1,2,4-triazol-1-yl)ethoxy]propanal | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OCC(C=O)OC(CN5C=NC=N5)(C6=C(C=C(C=C6)Cl)Cl)O | ||||||||
| InChI Identifier | InChI=1S/C35H38Cl2N8O5/c1-3-25(2)45-34(47)44(24-40-45)29-7-5-27(6-8-29)41-14-16-42(17-15-41)28-9-11-30(12-10-28)49-20-31(19-46)50-35(48,21-43-23-38-22-39-43)32-13-4-26(36)18-33(32)37/h4-13,18-19,22-25,31,48H,3,14-17,20-21H2,1-2H3 | ||||||||
| InChI Key | UGNSXICMOQFEIR-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 | ||||||||
