7-[(z)-3-chlorobut-2-enyl]-1,3-dimethyl-8-piperidin-1-ylpurine-2,6-dione (CHEM298794)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-28 19:59:30 UTC | ||||||||
| Update Date | 2026-08-28 19:59:30 UTC | ||||||||
| Accession Number | CHEM298794 | ||||||||
| Identification | |||||||||
| Common Name | 7-[(z)-3-chlorobut-2-enyl]-1,3-dimethyl-8-piperidin-1-ylpurine-2,6-dione | ||||||||
| Class | Small Molecule | ||||||||
| Description | 7-[(z)-3-chlorobut-2-enyl]-1,3-dimethyl-8-piperidin-1-ylpurine-2,6-dione belongs to the purines and purine derivatives, a subclass of imidazopyrimidines within the organic compounds. It is an organoheterocyclic compound with the formula C16H22ClN5O2 and an average molecular weight of 351.80 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C16H22ClN5O2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 351.146 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 7-[(z)-3-chlorobut-2-enyl]-1,3-dimethyl-8-piperidin-1-ylpurine-2,6-dione | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(=CCN1C2=C(N=C1N3CCCCC3)N(C(=O)N(C2=O)C)C)Cl | ||||||||
| InChI Identifier | InChI=1S/C16H22ClN5O2/c1-11(17)7-10-22-12-13(19(2)16(24)20(3)14(12)23)18-15(22)21-8-5-4-6-9-21/h7H,4-6,8-10H2,1-3H3/b11-7- | ||||||||
| InChI Key | VHYZYULJSZSTQJ-XFFZJAGNSA-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 | ||||||||
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| 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 | ||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
