3-(2-methylnaphtho[1,2-d][1,3]thiazol-1-ium-1-yl)propane-1-sulfonate
Chemical Structure Depiction of
3-(2-methylnaphtho[1,2-d][1,3]thiazol-1-ium-1-yl)propane-1-sulfonate
3-(2-methylnaphtho[1,2-d][1,3]thiazol-1-ium-1-yl)propane-1-sulfonate
Compound characteristics
| Compound ID: | 0082-0019 |
| Compound Name: | 3-(2-methylnaphtho[1,2-d][1,3]thiazol-1-ium-1-yl)propane-1-sulfonate |
| Molecular Weight: | 321.41 |
| Molecular Formula: | C15 H15 N O3 S2 |
| Smiles: | Cc1[n+](CCCS([O-])(=O)=O)c2c3ccccc3ccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 1.8386 |
| logD: | 1.8386 |
| logSw: | -2.6264 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.312 |
| InChI Key: | DTCXTTJRDSLBBR-UHFFFAOYSA-N |