8,9-dimethoxy-1-methyl-4,5-dihydro-6H-pyrrolo[1,2-a][1,4]benzodiazepine-6-thione
Chemical Structure Depiction of
8,9-dimethoxy-1-methyl-4,5-dihydro-6H-pyrrolo[1,2-a][1,4]benzodiazepine-6-thione
8,9-dimethoxy-1-methyl-4,5-dihydro-6H-pyrrolo[1,2-a][1,4]benzodiazepine-6-thione
Compound characteristics
| Compound ID: | 8019-9055 |
| Compound Name: | 8,9-dimethoxy-1-methyl-4,5-dihydro-6H-pyrrolo[1,2-a][1,4]benzodiazepine-6-thione |
| Molecular Weight: | 288.37 |
| Molecular Formula: | C15 H16 N2 O2 S |
| Smiles: | Cc1ccc2CNC(c3cc(c(cc3n12)OC)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 2.5078 |
| logD: | 2.5078 |
| logSw: | -2.8242 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.447 |
| InChI Key: | UPBMQVKGBZAAPT-UHFFFAOYSA-N |