8-[benzyl(methyl)amino]-7-[(z)-3-chlorobut-2-enyl]-1,3-dimethylpurine-2,6-dione (CHEM198854)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-20 03:18:36 UTC | ||||||||
| Update Date | 2026-08-20 03:18:36 UTC | ||||||||
| Accession Number | CHEM198854 | ||||||||
| Identification | |||||||||
| Common Name | 8-[benzyl(methyl)amino]-7-[(z)-3-chlorobut-2-enyl]-1,3-dimethylpurine-2,6-dione | ||||||||
| Class | Small Molecule | ||||||||
| Description | 8-[benzyl(methyl)amino]-7-[(z)-3-chlorobut-2-enyl]-1,3-dimethylpurine-2,6-dione belongs to the purines and purine derivatives, a subclass of imidazopyrimidines within the organic compounds. This organoheterocyclic compound has the chemical formula C19H22ClN5O2 and an average molecular weight of 387.90 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C19H22ClN5O2 | ||||||||
| Average Molecular Mass | 387.900 g/mol | ||||||||
| Monoisotopic Mass | 387.146 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 8-[benzyl(methyl)amino]-7-[(Z)-3-chlorobut-2-enyl]-1,3-dimethylpurine-2,6-dione | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C19H22ClN5O2/c1-13(20)10-11-25-15-16(23(3)19(27)24(4)17(15)26)21-18(25)22(2)12-14-8-6-5-7-9-14/h5-10H,11-12H2,1-4H3/b13-10- | ||||||||
| InChI Key | ZFKNVBQICUFZKT-RAXLEYEMSA-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 | ||||||||
