3-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-8-methyl-3,8-diazabicyclo[3.2.1]octane (CHEM322806)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-30 05:35:04 UTC | ||||||||
| Update Date | 2026-08-30 05:35:04 UTC | ||||||||
| Accession Number | CHEM322806 | ||||||||
| Identification | |||||||||
| Common Name | 3-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-8-methyl-3,8-diazabicyclo[3.2.1]octane | ||||||||
| Class | Small Molecule | ||||||||
| Description | 3-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-8-methyl-3,8-diazabicyclo[3.2.1]octane is a chemical compound with the formula C21H23ClN2S. It has an average molecular weight of 370.90 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C21H23ClN2S | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 370.127 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 3-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-8-methyl-3,8-diazabicyclo[3.2.1]octane | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CN1C2CCC1CN(C2)C3CC4=CC=CC=C4SC5=C3C=C(C=C5)Cl | ||||||||
| InChI Identifier | InChI=1S/C21H23ClN2S/c1-23-16-7-8-17(23)13-24(12-16)19-10-14-4-2-3-5-20(14)25-21-9-6-15(22)11-18(19)21/h2-6,9,11,16-17,19H,7-8,10,12-13H2,1H3 | ||||||||
| InChI Key | CVUNBKKKOOAHKT-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 |
| ||||||||
| 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 | ||||||||
