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 |