5-hydroxy-5-(4-nitrophenyl)-7-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-7-ium--bromide (1/1)
Chemical Structure Depiction of
5-hydroxy-5-(4-nitrophenyl)-7-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-7-ium--bromide (1/1)
5-hydroxy-5-(4-nitrophenyl)-7-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-7-ium--bromide (1/1)
Compound characteristics
| Compound ID: | K404-0011 |
| Compound Name: | 5-hydroxy-5-(4-nitrophenyl)-7-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-7-ium--bromide (1/1) |
| Molecular Weight: | 422.3 |
| Molecular Formula: | C17 H16 N3 O3 S |
| Salt: | Br- |
| Smiles: | C1CSC2N1C(C[N+]=2c1ccccc1)(c1ccc(cc1)[N+]([O-])=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3293 |
| logD: | 3.3293 |
| logSw: | -3.5468 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.259 |
| InChI Key: | XBWZJNDSSGQLNC-KRWDZBQOSA-N |