1-(4-chlorophenyl)-3-hydroxy-3-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium--bromide (1/1)
Chemical Structure Depiction of
1-(4-chlorophenyl)-3-hydroxy-3-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium--bromide (1/1)
1-(4-chlorophenyl)-3-hydroxy-3-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | K404-0336 |
| Compound Name: | 1-(4-chlorophenyl)-3-hydroxy-3-phenyl-2,3,6,7-tetrahydro-5H-imidazo[2,1-b][1,3]thiazin-1-ium--bromide (1/1) |
| Molecular Weight: | 425.77 |
| Molecular Formula: | C18 H18 Cl N2 O S |
| Salt: | Br- |
| Smiles: | C1CN2C(=[N+](CC2(c2ccccc2)O)c2ccc(cc2)[Cl])SC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7313 |
| logD: | 4.7313 |
| logSw: | -4.7691 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.5113 |
| InChI Key: | RCQNJIHIUFNCDD-SFHVURJKSA-N |