3-(3,5,6-trimethylthieno[2,3-d][1,2]thiazol-2-ium-2-yl)propane-1-sulfonate
Chemical Structure Depiction of
3-(3,5,6-trimethylthieno[2,3-d][1,2]thiazol-2-ium-2-yl)propane-1-sulfonate
3-(3,5,6-trimethylthieno[2,3-d][1,2]thiazol-2-ium-2-yl)propane-1-sulfonate
Compound characteristics
| Compound ID: | 7771-0782 |
| Compound Name: | 3-(3,5,6-trimethylthieno[2,3-d][1,2]thiazol-2-ium-2-yl)propane-1-sulfonate |
| Molecular Weight: | 305.43 |
| Molecular Formula: | C11 H15 N O3 S3 |
| Smiles: | Cc1c(C)sc2c(C)[n+](CCCS([O-])(=O)=O)sc12 |
| Stereo: | ACHIRAL |
| logP: | 1.4475 |
| logD: | 1.4475 |
| logSw: | -1.4232 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.14 |
| InChI Key: | ZELYIFACAISKRK-UHFFFAOYSA-N |