3-ethyl-5-methoxy-2-{2-[methyl(phenyl)amino]ethenyl}-1,3-benzothiazol-3-ium--perchlorate (1/1)
Chemical Structure Depiction of
3-ethyl-5-methoxy-2-{2-[methyl(phenyl)amino]ethenyl}-1,3-benzothiazol-3-ium--perchlorate (1/1)
3-ethyl-5-methoxy-2-{2-[methyl(phenyl)amino]ethenyl}-1,3-benzothiazol-3-ium--perchlorate (1/1)
Compound characteristics
| Compound ID: | 2421-0081 |
| Compound Name: | 3-ethyl-5-methoxy-2-{2-[methyl(phenyl)amino]ethenyl}-1,3-benzothiazol-3-ium--perchlorate (1/1) |
| Molecular Weight: | 424.9 |
| Molecular Formula: | C19 H21 N2 O S |
| Salt: | ClO4- |
| Smiles: | CC[n+]1c2cc(ccc2sc1/C=C/N(C)c1ccccc1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2116 |
| logD: | 4.2116 |
| logSw: | -4.3155 |
| Hydrogen bond acceptors count: | 1 |
| Polar surface area: | 11.1141 |
| InChI Key: | PISAPCABIMWVIO-UHFFFAOYSA-N |