3-hydroxy-1-(4-methylphenyl)-3-(3-nitrophenyl)-2,3,5,6,7,8-hexahydroimidazo[1,2-a]pyridin-1-ium--bromide (1/1)
Chemical Structure Depiction of
3-hydroxy-1-(4-methylphenyl)-3-(3-nitrophenyl)-2,3,5,6,7,8-hexahydroimidazo[1,2-a]pyridin-1-ium--bromide (1/1)
3-hydroxy-1-(4-methylphenyl)-3-(3-nitrophenyl)-2,3,5,6,7,8-hexahydroimidazo[1,2-a]pyridin-1-ium--bromide (1/1)
Compound characteristics
| Compound ID: | K404-0661 |
| Compound Name: | 3-hydroxy-1-(4-methylphenyl)-3-(3-nitrophenyl)-2,3,5,6,7,8-hexahydroimidazo[1,2-a]pyridin-1-ium--bromide (1/1) |
| Molecular Weight: | 432.32 |
| Molecular Formula: | C20 H22 N3 O3 |
| Salt: | Br- |
| Smiles: | Cc1ccc(cc1)[N+]1CC(c2cccc(c2)[N+]([O-])=O)(N2CCCCC=12)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0372 |
| logD: | 4.0372 |
| logSw: | -3.9396 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.192 |
| InChI Key: | DHQNFGHXNPWLQT-FQEVSTJZSA-N |