7-[(z)-3-chlorobut-2-enyl]-1,3-dimethyl-8-[(2e)-2-[(3-nitrophenyl)methylidene]hydrazinyl]purine-2,6-dione (CHEM307554)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-29 07:58:10 UTC | ||||||||
| Update Date | 2026-08-29 07:58:10 UTC | ||||||||
| Accession Number | CHEM307554 | ||||||||
| Identification | |||||||||
| Common Name | 7-[(z)-3-chlorobut-2-enyl]-1,3-dimethyl-8-[(2e)-2-[(3-nitrophenyl)methylidene]hydrazinyl]purine-2,6-dione | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C18H18ClN7O4 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 431.111 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 7-[(z)-3-chlorobut-2-enyl]-1,3-dimethyl-8-[(2e)-2-[(3-nitrophenyl)methylidene]hydrazinyl]purine-2,6-dione | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(=CCN1C2=C(N=C1NN=CC3=CC(=CC=C3)[N+](=O)[O-])N(C(=O)N(C2=O)C)C)Cl | ||||||||
| InChI Identifier | InChI=1S/C18H18ClN7O4/c1-11(19)7-8-25-14-15(23(2)18(28)24(3)16(14)27)21-17(25)22-20-10-12-5-4-6-13(9-12)26(29)30/h4-7,9-10H,8H2,1-3H3,(H,21,22)/b11-7-,20-10+ | ||||||||
| InChI Key | KRVZVPVSLLQPFI-KBNINJOHSA-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 |
| ||||||||
| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
| ||||||||
| 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 | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
