3-(2-fluoro-4-methoxyphenyl)-3-hydroxy-2-methyl-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium
Chemical Structure Depiction of
3-(2-fluoro-4-methoxyphenyl)-3-hydroxy-2-methyl-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium
3-(2-fluoro-4-methoxyphenyl)-3-hydroxy-2-methyl-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium
Compound characteristics
| Compound ID: | K843-0063 |
| Compound Name: | 3-(2-fluoro-4-methoxyphenyl)-3-hydroxy-2-methyl-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium |
| Molecular Weight: | 453.37 |
| Molecular Formula: | C20 H22 F N2 O2 S |
| Salt: | Br- |
| Smiles: | CC1C(c2ccc(cc2F)OC)(N2CCCSC2=[N+]1c1ccccc1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8933 |
| logD: | 4.8933 |
| logSw: | -4.5233 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.4226 |
| InChI Key: | JKEFHHHDDIZNMW-UHFFFAOYSA-N |