3-[4-(difluoromethoxy)phenyl]-3-hydroxy-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium--bromide (1/1)
Chemical Structure Depiction of
3-[4-(difluoromethoxy)phenyl]-3-hydroxy-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium--bromide (1/1)
3-[4-(difluoromethoxy)phenyl]-3-hydroxy-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | K843-0013 |
| Compound Name: | 3-[4-(difluoromethoxy)phenyl]-3-hydroxy-1-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium--bromide (1/1) |
| Molecular Weight: | 457.34 |
| Molecular Formula: | C19 H19 F2 N2 O2 S |
| Salt: | Br- |
| Smiles: | C1CN2C(=[N+](CC2(c2ccc(cc2)OC(F)F)O)c2ccccc2)SC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2054 |
| logD: | 4.2054 |
| logSw: | -4.1459 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.1163 |
| InChI Key: | CWKKPPADRMBSBL-IBGZPJMESA-N |