5,5-dimethyl-2,3,5,6-tetrahydro[1,3]thiazolo[2,3-a]isoquinolin-4-ium--bromide (1/1)
Chemical Structure Depiction of
5,5-dimethyl-2,3,5,6-tetrahydro[1,3]thiazolo[2,3-a]isoquinolin-4-ium--bromide (1/1)
5,5-dimethyl-2,3,5,6-tetrahydro[1,3]thiazolo[2,3-a]isoquinolin-4-ium--bromide (1/1)
Compound characteristics
| Compound ID: | 8011-1859 |
| Compound Name: | 5,5-dimethyl-2,3,5,6-tetrahydro[1,3]thiazolo[2,3-a]isoquinolin-4-ium--bromide (1/1) |
| Molecular Weight: | 298.24 |
| Molecular Formula: | C13 H16 N S |
| Salt: | Br- |
| Smiles: | CC1(C)Cc2ccccc2C2=[N+]1CCS2 |
| Stereo: | ACHIRAL |
| logP: | 2.8672 |
| logD: | 2.8672 |
| logSw: | -3.2896 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 3.1201 |
| InChI Key: | JGSITVKWCDIFSU-UHFFFAOYSA-N |